methyl 2-({cyclohexyl[(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amino}methyl)benzoate
Chemical Structure Depiction of
methyl 2-({cyclohexyl[(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amino}methyl)benzoate
methyl 2-({cyclohexyl[(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amino}methyl)benzoate
Compound characteristics
| Compound ID: | V024-7003 |
| Compound Name: | methyl 2-({cyclohexyl[(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amino}methyl)benzoate |
| Molecular Weight: | 484.56 |
| Molecular Formula: | C28 H31 F3 N2 O2 |
| Salt: | not_available |
| Smiles: | COC(c1ccccc1CN(Cc1cccn1Cc1cccc(c1)C(F)(F)F)C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.647 |
| logD: | 5.8952 |
| logSw: | -5.8396 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.0594 |
| InChI Key: | WAZDHKGXQDLCGR-UHFFFAOYSA-N |