N-(cyclopropylmethyl)-4-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-4-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
N-(cyclopropylmethyl)-4-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V001-0914 |
| Compound Name: | N-(cyclopropylmethyl)-4-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 517.6 |
| Molecular Formula: | C29 H32 F N5 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1ccc(nn1)N1CCCN(CC1)C(CN(CC1CC1)C(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8828 |
| logD: | 3.879 |
| logSw: | -3.9439 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.164 |
| InChI Key: | USMAHKHQBKSOHT-UHFFFAOYSA-N |