N-cyclopropyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)thiophene-2-carboxamide
N-cyclopropyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V028-1411 |
| Compound Name: | N-cyclopropyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)thiophene-2-carboxamide |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C26 H29 N5 O3 S |
| Smiles: | COc1cccc(c1)c1ccc(nn1)N1CCCN(CC1)C(CN(C1CC1)C(c1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7037 |
| logD: | 3.5337 |
| logSw: | -3.979 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.234 |
| InChI Key: | IGAJIPYWHRHFHM-UHFFFAOYSA-N |