2,4-difluoro-N-(6-{4-[(3-methoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Chemical Structure Depiction of
2,4-difluoro-N-(6-{4-[(3-methoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
2,4-difluoro-N-(6-{4-[(3-methoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Compound characteristics
| Compound ID: | V013-0895 |
| Compound Name: | 2,4-difluoro-N-(6-{4-[(3-methoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide |
| Molecular Weight: | 452.5 |
| Molecular Formula: | C25 H26 F2 N4 O2 |
| Salt: | not_available |
| Smiles: | COc1cccc(CN2CCCN(CC2)c2ccc(cn2)NC(c2ccc(cc2F)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8296 |
| logD: | 3.6241 |
| logSw: | -4.456 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.798 |
| InChI Key: | DMCSDPNIXSAJBS-UHFFFAOYSA-N |