C21H18N4O5 structure

C21H18N4O5

(2S)-12-methoxy-2-methyl-4-(4-nitrophenyl)-4,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),10(15),11,13-tetraene-3,5-dione

Also Known As: (11bS)-8-methoxy-11b-methyl-2-(4-nitrophenyl)-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione|(S)-8-methoxy-11b-methyl-2-(4-nitrophenyl)-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione

CAS: 956435-67-9
Molecular Formula C21H18N4O5
Molecular Weight 406.12772 g/mol
LogP 3.3248
Topological Polar Surface Area 108.78 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 406.12772
Monoisotopic Mass 406.12772
Heavy Atoms 30
Complexity 1232.1726

Chemical Identifiers

CAS Number 956435-67-9
SMILES C[C@@]12C3=C(CCN1C(=O)N(C2=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=C(N3)C=CC(=C5)OC

Product Overview

C21H18N4O5 (CAS 956435-67-9), with molecular formula C21H18N4O5 and molecular weight 406.12772 g/mol. IUPAC: (2S)-12-methoxy-2-methyl-4-(4-nitrophenyl)-4,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),10(15),11,13-tetraene-3,5-dione.

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