N-benzyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-phenylacetamide
Chemical Structure Depiction of
N-benzyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-phenylacetamide
N-benzyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-phenylacetamide
Compound characteristics
| Compound ID: | V023-1038 |
| Compound Name: | N-benzyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-phenylacetamide |
| Molecular Weight: | 549.67 |
| Molecular Formula: | C33 H35 N5 O3 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1ccc(nn1)N1CCCN(CC1)C(CN(Cc1ccccc1)C(Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5739 |
| logD: | 4.404 |
| logSw: | -4.5053 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.113 |
| InChI Key: | BHJSPVRPDXNLAQ-UHFFFAOYSA-N |