2-cyclopentyl-N-[(4-ethoxyphenyl)methyl]-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Chemical Structure Depiction of
2-cyclopentyl-N-[(4-ethoxyphenyl)methyl]-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
2-cyclopentyl-N-[(4-ethoxyphenyl)methyl]-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Compound characteristics
Compound ID: | C329-0470 |
Compound Name: | 2-cyclopentyl-N-[(4-ethoxyphenyl)methyl]-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide |
Molecular Weight: | 443.55 |
Molecular Formula: | C27 H29 N3 O3 |
Smiles: | CCOc1ccc(CNC(C2=CN(C3CCCC3)C(c3c2c2ccccc2n3C)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.7489 |
logD: | 3.7489 |
logSw: | -4.2103 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.414 |
InChI Key: | RLXDHTQHPDOUDP-UHFFFAOYSA-N |