N-(6-{4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-difluorobenzamide
Chemical Structure Depiction of
N-(6-{4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-difluorobenzamide
N-(6-{4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-difluorobenzamide
Compound characteristics
| Compound ID: | V012-4367 |
| Compound Name: | N-(6-{4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-difluorobenzamide |
| Molecular Weight: | 482.53 |
| Molecular Formula: | C26 H28 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(CN2CCCN(CC2)c2ccc(cn2)NC(c2cc(cc(c2)F)F)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.1104 |
| logD: | 4.9763 |
| logSw: | -4.9033 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.429 |
| InChI Key: | VFTGNVDBVZJZBY-UHFFFAOYSA-N |