2-(3-fluorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]azepane
Chemical Structure Depiction of
2-(3-fluorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]azepane
2-(3-fluorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]azepane
Compound characteristics
| Compound ID: | J006-1368 |
| Compound Name: | 2-(3-fluorophenyl)-1-[(2,3,4-trimethoxyphenyl)methyl]azepane |
| Molecular Weight: | 373.47 |
| Molecular Formula: | C22 H28 F N O3 |
| Smiles: | COc1ccc(CN2CCCCCC2c2cccc(c2)F)c(c1OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7661 |
| logD: | 3.3134 |
| logSw: | -4.6593 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.9546 |
| InChI Key: | YWFBYBBZJDLFPV-IBGZPJMESA-N |