2-{[3-(4-(2-Chlorophenyl)-9-hydroxy-1,3-dioxo-2,3-dihydropyrrolo[3,4-c]carbazol-6 (1H)-yl)propyl]amino}benzoic acid

HCID 69583986
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Basic information

Standard SMILES
O=C(O)c1ccccc1NCCCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O
InChIKey
FOJWBCNQEZVWFV-UHFFFAOYSA-N
Molecular formula
C30H22ClN3O5
Average molar mass
540 g/mol

Names & identifiers

Preferred name
2-{[3-(4-(2-Chlorophenyl)-9-hydroxy-1,3-dioxo-2,3-dihydropyrrolo[3,4-c]carbazol-6 (1H)-yl)propyl]amino}benzoic acid
IUPAC
2-[3-[4-(2-chlorophenyl)-9-hydroxy-1,3-dioxopyrrolo[3,4-c]carbazol-6-yl]propylamino]benzoic acid

Names & synonyms

SCHEMBL5829451FOJWBCNQEZVWFV-UHFFFAOYSA-N2-{[3-(4-(2-Chlorophenyl)-9-hydroxy-1,3-dioxo-2,3-dihydropyrrolo[3,4-c]carbazol-6 (1H)-yl)propyl]amino}benzoic acid

Database identifiers

PubChem CID
69583986

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
121 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
39

Related reactions

1 records
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Linked notes

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