N-benzyl-3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
N-benzyl-3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
N-benzyl-3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V003-5069 |
| Compound Name: | N-benzyl-3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 553.64 |
| Molecular Formula: | C32 H32 F N5 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1ccc(nn1)N1CCCN(CC1)C(CN(Cc1ccccc1)C(c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3458 |
| logD: | 4.342 |
| logSw: | -4.3583 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.64 |
| InChI Key: | YSEQXNHNFXKRKK-UHFFFAOYSA-N |