N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-phenylethyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-phenylethyl)thiophene-2-carboxamide
N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-phenylethyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V008-1530 |
| Compound Name: | N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(2-phenylethyl)thiophene-2-carboxamide |
| Molecular Weight: | 555.7 |
| Molecular Formula: | C31 H33 N5 O3 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1ccc(nn1)N1CCCN(CC1)C(CN(CCc1ccccc1)C(c1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6936 |
| logD: | 4.6898 |
| logSw: | -4.3942 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.637 |
| InChI Key: | ULADHVALLSHSJK-UHFFFAOYSA-N |