N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-cyclohexyl-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-cyclohexyl-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-cyclohexyl-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Compound characteristics
| Compound ID: | C329-0635 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-cyclohexyl-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C27 H27 N3 O4 |
| Smiles: | Cn1c2C(N(C=C(C(NCc3ccc4c(c3)OCO4)=O)c2c2ccccc12)C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8307 |
| logD: | 3.8307 |
| logSw: | -4.2218 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.039 |
| InChI Key: | DGJKDWAGFUWOTO-UHFFFAOYSA-N |