EX 527
6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
Molecular Identity
EX 527
6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
PubChem CID: 5113032
6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide is a member of the class of carbazoles that is 2,3,4,9-tetrahydro-1H-carbazole which is substituted at position 1 by an aminocarbohyl group and at position 6 by a chlorine. It is a monocarboxylic acid amide, an organochlorine compound and a member of carbazoles.
2D Structure
Properties
C13H13ClN2O
Molecular Formula
248.71
Molecular Weight
g/mol
248.0716
Exact Mass
Da
2.5
XLogP
Drug-like (Lipinski: < 5)
58.9
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
1
H-Bond Acceptors
323
Complexity
SMILES
Canonical SMILES
SMILES: C1CC(C2=C(C1)C3=C(N2)C=CC(=C3)Cl)C(=O)NIsomeric SMILES
SMILES: C1CC(C2=C(C1)C3=C(N2)C=CC(=C3)Cl)C(=O)NSynonyms(20)
49843-98-3Selisistat6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamideEX-527EX 527L19ECD5014rac-6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamideCHEBI:90369DTXSID10964442EX527 cpdselisistatumRefChem:541450DTXCID101392140664-029-6SEN0014196
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to EX 527
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