Molecule ID: 707029

IUPAC Name: (1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide

Description: The molecule is a 6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide that has S configuration It is the active enantiomer. It has a role as a Sir1 inhibitor. It is an enantiomer of a (R)-selisistat.

SMILES: N=C(O)[C@H]1CCCc2c1[nH]c1ccc(Cl)cc21

SELFIES: [N][=C][Branch1][C][O][C@H1][C][C][C][C][=C][Ring1][=Branch1][NH1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch2][Ring1][#Branch1]

InChI: InChI=1S/C13H13ClN2O/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(15)17)12(8)16-11/h4-6,9,16H,1-3H2,(H2,15,17)/t9-/m0/s1

Molecular Properties:
- Polar Surface Area: 58.9 Ų
- LogP: 2.5