4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V007-5687 |
| Compound Name: | 4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 588.08 |
| Molecular Formula: | C32 H31 Cl F N5 O3 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1ccc(nn1)N1CCCN(CC1)C(CN(Cc1ccc(cc1)F)C(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.887 |
| logD: | 4.717 |
| logSw: | -5.0858 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.64 |
| InChI Key: | VPZJXKGZDSJGHD-UHFFFAOYSA-N |