 Home > Encyclopedia > benzyl N-[6,19-bis(acetamidomethylsulfanylmethyl)-9,22-dimethyl-2,5,8, 11,15,18,21,24-octaoxo-25-phenylmethoxycarbonylamino-3,16-dipropyl-1,1 4-dioxa-4,7,10,17,20,23-hexazacyclohexacos-12-yl]carbamate

benzyl N-[6,19-bis(acetamidomethylsulfanylmethyl)-9,22-dimethyl-2,5,8, 11,15,18,21,24-octaoxo-25-phenylmethoxycarbonylamino-3,16-dipropyl-1,1 4-dioxa-4,7,10,17,20,23-hexazacyclohexacos-12-yl]carbamate

benzyl N-[6,19-bis(acetamidomethylsulfanylmethyl)-9,22-dimethyl-2,5,8, 11,15,18,21,24-octaoxo-25-phenylmethoxycarbonylamino-3,16-dipropyl-1,1 4-dioxa-4,7,10,17,20,23-hexazacyclohexacos-12-yl]carbamate structure

CAS No:
63519-99-3
Formula:
C50H70N10O16S2
Chemical Name:
benzyl N-[6,19-bis(acetamidomethylsulfanylmethyl)-9,22-dimethyl-2,5,8, 11,15,18,21,24-octaoxo-25-phenylmethoxycarbonylamino-3,16-dipropyl-1,1 4-dioxa-4,7,10,17,20,23-hexazacyclohexacos-12-yl]carbamate
Synonyms:
CTK5B9412;L-Valine, N-((phenylmethoxy)carbonyl)-D-seryl-L-alanyl-S-((acetylamino)methyl)-L-cysteinyl-, bimol. (4->1"),(4"->1)-dilactone;BENZYL N-[6,19-BIS(ACETAMIDOMETHYLSULFANYLMETHYL)-9,22-DIMETHYL-2,5,8,11,15,18,21,24-OCTAOXO-25-PHENYLMETHOXYCARBONYLAMINO-3,16-DIPROPYL-1,14-DIOXA-4,7,10,17,20,23-HEXAZACYCLOHEXACOS-12-YL]CARBAMATE

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benzyl N-[6,19-bis(acetamidomethylsulfanylmethyl)-9,22-dimethyl-2,5,8, 11,15,18,21,24-octaoxo-25-phenylmethoxycarbonylamino-3,16-dipropyl-1,1 4-dioxa-4,7,10,17,20,23-hexazacyclohexacos-12-yl]carbamate Basic Attributes

Molecular Weight：

1131.2782

Exact Mass：

1130.441

Characteristics

PSA：

413

XLogP3：

Computed Properties

Molecular Weight:1131.3
XLogP3:2
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:20
Exact Mass:1130.44126853
Monoisotopic Mass:1130.44126853
Topological Polar Surface Area:413
Heavy Atom Count:78
Complexity:1910
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of benzyl N-[6,19-bis(acetamidomethylsulfanylmethyl)-9,22-dimethyl-2,5,8, 11,15,18,21,24-octaoxo-25-phenylmethoxycarbonylamino-3,16-dipropyl-1,1 4-dioxa-4,7,10,17,20,23-hexazacyclohexacos-12-yl]carbamate

Basic Attributes
Characteristics
Computed Properties

benzyl N-[6,19-bis(acetamidomethylsulfanylmethyl)-9,22-dimethyl-2,5,8, 11,15,18,21,24-octaoxo-25-phenylmethoxycarbonylamino-3,16-dipropyl-1,1 4-dioxa-4,7,10,17,20,23-hexazacyclohexacos-12-yl]carbamate

SDS

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