 Home > Encyclopedia > [2-hydroxy-9,11,11-trimethyl-3-(5-oxo-2-sulfanylideneimidazol-4-yl)-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7,9-pentaen-6-yl] naphthalene-1-carboxylate

[2-hydroxy-9,11,11-trimethyl-3-(5-oxo-2-sulfanylideneimidazol-4-yl)-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7,9-pentaen-6-yl] naphthalene-1-carboxylate

[2-hydroxy-9,11,11-trimethyl-3-(5-oxo-2-sulfanylideneimidazol-4-yl)-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7,9-pentaen-6-yl] naphthalene-1-carboxylate structure

CAS No:
1164480-44-7
Formula:
C28H21N3O4S
Chemical Name:
[2-hydroxy-9,11,11-trimethyl-3-(5-oxo-2-sulfanylideneimidazol-4-yl)-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7,9-pentaen-6-yl] naphthalene-1-carboxylate
Synonyms:
(1Z)-4,4,6-trimethyl-2-oxo-1-(5-oxo-2-thioxoimidazolidin-4-ylidene)-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl naphthalene-1-carboxylate;SMR000145673;MLS000551748;Naphthalene-1-carboxylic acid 4,4,6-trimethyl-2-oxo-1-[5-oxo-2-thioxo-imidazolidin-(4Z)-ylidene]-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoli n-8-yl ester;MLS003903472;CHEMBL1563156;HMS2189F18;STK167129;AKOS002231619;ZINC100121356;MCULE-3110213718;ST50107182;1164480-44-7;4,4,6-trimethyl-2-oxo-1-(5-oxo-2-thioxo-4-imidazolidinylidene)-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 1-naphthalenecarboxylate

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[2-hydroxy-9,11,11-trimethyl-3-(5-oxo-2-sulfanylideneimidazol-4-yl)-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7,9-pentaen-6-yl] naphthalene-1-carboxylate Basic Attributes

Molecular Weight：

495.5 g/mol

Exact Mass：

495.12527733 g/mol

Characteristics

PSA：

125 Å²

Computed Properties

Molecular Weight:495.5
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:495.12527733
Monoisotopic Mass:495.12527733
Topological Polar Surface Area:125
Heavy Atom Count:36
Complexity:1040
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-hydroxy-9,11,11-trimethyl-3-(5-oxo-2-sulfanylideneimidazol-4-yl)-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7,9-pentaen-6-yl] naphthalene-1-carboxylate

Basic Attributes
Characteristics
Computed Properties
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