methyl 4-chloro-2-{[1-(4-fluorophenyl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-chloro-2-{[1-(4-fluorophenyl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl]amino}benzoate
methyl 4-chloro-2-{[1-(4-fluorophenyl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | E864-0217 |
| Compound Name: | methyl 4-chloro-2-{[1-(4-fluorophenyl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl]amino}benzoate |
| Molecular Weight: | 477.92 |
| Molecular Formula: | C26 H21 Cl F N3 O3 |
| Smiles: | COC(c1ccc(cc1NC(N1CCc2c3ccccc3[nH]c2C1c1ccc(cc1)F)=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8846 |
| logD: | 5.8548 |
| logSw: | -6.1477 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.368 |
| InChI Key: | VJGTYBOYBNEYJV-XMMPIXPASA-N |