N-(2-methoxyethyl)-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}thiophene-2-carboxamide
N-(2-methoxyethyl)-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V001-7881 |
| Compound Name: | N-(2-methoxyethyl)-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}thiophene-2-carboxamide |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C25 H29 N5 O3 S |
| Smiles: | COCCN(CC(N1CCCN(CC1)c1ccc(c2ccccc2)nn1)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8972 |
| logD: | 2.8911 |
| logSw: | -3.0526 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.707 |
| InChI Key: | YSXCDOBUZQVFQP-UHFFFAOYSA-N |