C21H21N31N3O6, α - [(1-Naphthallethlethlmylmillimp) Amino] - α -oxo- (Aci) Gurat

C21H21N31N3O6, α - [(1-Naphthallethyl

Inpormasi dasar:

Kirim email ka kami

Jénmén produk

Tag produk

Jéntré zat

CAT Nomer Pendaptaran

1262015-90-60

Sipat fisik konci	Nilai	Kaayaan
Beurat molekular	411.41	-
Kapadetan (diprediksi)	1,460 ± 0,06 g / cm3	Temp: 20 ° C; Pencét: 760 Torr
Pair (diprediksi)	8.23 ± 0,10	TEMP anu paling asam: 25 ° C

Ngaran sareng identifikasi

Imut

O = c1nc (= o) n (c = c1c (= o) ncc2 = cc = cc = cc = c4) c4) c4) Ck = ck) c4) Ck = ck) c4) C2) C4

Imutterik

O = C1N (C = C (C (NCC = 2c3 = C (C = CC2) C = CC = C3) C3)?

Atchi

Inchi = 1s / C21h21n3o6 / C25-11-16 (26) 8-18) 2-17-15) 27-6-14) 22-6-14) 22-17) 22-14 7,10,16-18,25-26h, 8-9,111, (H, 22,27) (H, 23,28,28) / S1 +

Konci inci

Uudhoszawegtb-rccfbdpsvsa-n

3 ngaran séjén pikeun zat ieu

α - [(1-Naphthalylmylmylmilyl) amino] - α -oxynysysypine (Aci); (Napdu); 87: PN: wo2020081510 SEQID: 87 urutan anu ngaku

Sipat sayogi
Biologis
Kimia
Perténaran
Lipinski
Struktur patali

Biologis

Harta	Nilai	Kaayaan	Sumber
Faktor bioconcation	3.23	pH 1; Temp: 25 ° C	(1) ACD
Faktor bioconcation	3.23	pH 2; Temp: 25 ° C	(1) ACD
Faktor bioconcation	3.23	pH 3; Temp: 25 ° C	(1) ACD
Faktor bioconcation	3.23	pH 4; Temp: 25 ° C	(1) ACD
Faktor bioconcation	3.23	pH 5; Temp: 25 ° C	(1) ACD
Faktor bioconcation	3.19	pH 6; Temp: 25 ° C	(1) ACD
Faktor bioconcation	2.85	pH 7; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.40	pH 8; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.0	pH 9; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.0	pH 10; Temp: 25 ° C	(1) ACD

(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)

Kimia

Sumber kaayaan nilai harta

KOC 80.5 pH 1; Temp: 25 ° C (1) acd

Koc 80.5 pH 2; Temp: 25 ° C (1) acd

KOC 80.5 pH 3; Temp: 25 ° C (1) acd

Koc 80.5 pH 4; Temp: 25 ° C (1) acd

KOC 80.4 PH 5; Temp: 25 ° C (1) acd

Koc 79.5 pH 6; Temp: 25 ° C (1) acd

Koc 71.1 PH 7; Temp: 25 ° C (1) acd

Koc 34,9 pH 8; Temp: 25 ° C (1) acd

Koc 6.35 pH 9; Temp: 25 ° C (1) acd

Koc 1.39 ph 10; Temp: 25 ° C (1) acd

LogD 0,97 pH 1; Temp: 25 ° C (1) acd

LogD 0,97 pH 2; Temp: 25 ° C (1) acd

Harta	Nilai	Kaayaan	Sumber
log As	0,97	pH 3; Temp: 25 ° C	(1) ACD
log As	0,97	pH 4; Temp: 25 ° C	(1) ACD
log As	0,97	pH 5; Temp: 25 ° C	(1) ACD
log As	0,97	pH 6; Temp: 25 ° C	(1) ACD
log As	0,92	pH 7; Temp: 25 ° C	(1) ACD
log As	0,61	pH 8; Temp: 25 ° C	(1) ACD
log As	-0.13	pH 9; Temp: 25 ° C	(1) ACD
log As	-0.79	pH 10; Temp: 25 ° C	(1) ACD
logp	0.973 ± 0.586	Temp: 25 ° C	(1) ACD
Kebar intrinsik massic	5.3 x 10-3 g / l	Temp: 25 ° C	(1) ACD
Sahubat massa	5.3 x 10-3 g / l	pH 1; Temp: 25 ° C	(1) ACD
Sahubat massa	5.3 x 10-3 g / l	pH 2; Temp: 25 ° C	(1) ACD
Sahubat massa	5.3 x 10-3 g / l	pH 3; Temp: 25 ° C	(1) ACD
Sahubat massa	5.3 x 10-3 g / l	pH 4; Temp: 25 ° C	(1) ACD
Sahubat massa	5.3 x 10-3 g / l	pH 5; Temp: 25 ° C	(1) ACD
Sahubat massa	5.3 x 10-3 g / l	pH 6; Temp: 25 ° C	(1) ACD
Sahubat massa	5.8 x 10-3 g / l	pH 7; Temp: 25 ° C	(1) ACD
Sahubat massa	0,012 g / l	pH 8; Temp: 25 ° C	(1) ACD
Sahubat massa	0,066 g / l	pH 9; Temp: 25 ° C	(1) ACD
Sahubat massa	0,30 g / l	pH 10; Temp: 25 ° C	(1) ACD
Sahubat massa	5.3 x 10-3 g / l	Cai pH 6,37; Temp: 25 ° C	(1) ACD
Kebar intrinsik molar	1.3 x 10-5 mol / l	Temp: 25 ° C	(1) ACD
Kahirupan molar	1.3 x 10-5 mol / l	pH 1; Temp: 25 ° C	(1) ACD
Kahirupan molar	1.3 x 10-5 mol / l	pH 2; Temp: 25 ° C	(1) ACD
Kahirupan molar	1.3 x 10-5 mol / l	pH 3; Temp: 25 ° C	(1) ACD
Kahirupan molar	1.3 x 10-5 mol / l	pH 4; Temp: 25 ° C	(1) ACD
Kahirupan molar	1.3 x 10-5 mol / l	pH 5; Temp: 25 ° C	(1) ACD
Kahirupan molar	1.3 x 10-5 mol / l	pH 6; Temp: 25 ° C	(1) ACD
Kahirupan molar	1.4 x 10-5 mol / l	pH 7; Temp: 25 ° C	(1) ACD
Kahirupan molar	2.9 x 10-5 mol / l	pH 8; Temp: 25 ° C	(1) ACD
Kahirupan molar	1.6 x 10-4 mol / l	pH 9; Temp: 25 ° C	(1) ACD
Kahirupan molar	7,4 x 10-4 mol / l	pH 10; Temp: 25 ° C	(1) ACD

Harta	Nilai	Kaayaan	Sumber
Kahirupan molar	1.3 x 10-5 mol / l	Cai pH 6,37; Temp: 25 ° C	(1) ACD
Beurat molekular	411.41
Pka	8.23 ± 0,10	TEMP anu paling asam: 25 ° C	(1) ACD
Pka	-1.90 ± 0,20	Paling dasar temp: 25 ° C	(1) ACD

Perténaran

Harta	Nilai	Kaayaan	Sumber
Perténaran	1,460 ± 0,06 g / cm3	Temp: 20 ° C; Pencét: 760 Torr	(1) ACD
Masar	281.6 ± 3.0 cm3 / mol	Temp: 20 ° C; Pencét: 760 Torr	(1) ACD

Lipinski

Harta	Nilai	Kaayaan	Sumber
Beungkeut bébas rotét	7		(1) ACD
H panarima	9		(1) ACD
H donor	4		(1) ACD
H donor / panarima	13		(1) ACD
logp	0.973 ± 0.586	Temp: 25 ° C	(1) ACD
Beurat molekular	411.41