CID5210726 structure

CID5210726

3-bromo-N-(5-thia-3-azatetracyclo[6.6.1.02,6.011,15]pentadeca-1(14),2(6),3,7,11(15),12-hexaen-4-yl)benzamide

Also Known As: AB00672496-01|3-bromo-N-(4,5-dihydroacenaphtho[5,4-d]thiazol-8-yl)benzamide|F0779-0426|3-bromo-N-{5-thia-3-azatetracyclo[6.6.1.0^{2,6}.0^{11,15}]pentadeca-1(15),2(6),3,7,11,13-hexaen-4-yl}benzamide|3-bromo-N-(5-thia-3-azatetracyclo[6.6.1.02,6.011,15]pentadeca-1(14),2(6),3,7,11(15),12-hexaen-4-yl)benzamide

CAS: 477325-75-0
Molecular Formula C20H13BrN2OS
Molecular Weight 407.9932 g/mol
LogP 5.5629
Topological Polar Surface Area 41.99 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 407.9932
Monoisotopic Mass 407.9932
Heavy Atoms 25
Complexity 1165.2532

Chemical Identifiers

CAS Number 477325-75-0
SMILES C1CC2=CC3=C(C4=CC=CC1=C24)N=C(S3)NC(=O)C5=CC(=CC=C5)Br

Product Overview

CID5210726 (CAS 477325-75-0), with molecular formula C20H13BrN2OS and molecular weight 407.9932 g/mol. IUPAC: 3-bromo-N-(5-thia-3-azatetracyclo[6.6.1.02,6.011,15]pentadeca-1(14),2(6),3,7,11(15),12-hexaen-4-yl)benzamide.

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