methyl (3RS)-1-(2,4-dichlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
Chemical Structure Depiction of
methyl (3RS)-1-(2,4-dichlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
methyl (3RS)-1-(2,4-dichlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
Compound characteristics
| Compound ID: | Y042-7990 |
| Compound Name: | methyl (3RS)-1-(2,4-dichlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate |
| Molecular Weight: | 375.25 |
| Molecular Formula: | C19 H16 Cl2 N2 O2 |
| Smiles: | COC([C@@H]1Cc2c3ccccc3[nH]c2C(c2ccc(cc2[Cl])[Cl])N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4912 |
| logD: | 4.4907 |
| logSw: | -4.4837 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.973 |
| InChI Key: | GRNZPDVXMDBGHG-BHWOMJMDSA-N |