1-(3-methoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
1-(3-methoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
1-(3-methoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V009-3055 |
| Compound Name: | 1-(3-methoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 400.44 |
| Molecular Formula: | C23 H23 F3 N2 O |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C1c2cccn2CCCN1Cc1cccc(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2889 |
| logD: | 5.2071 |
| logSw: | -5.5237 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 13.4856 |
| InChI Key: | DDDSFRCYXSNJTC-JOCHJYFZSA-N |