N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(propan-2-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(propan-2-yl)thiophene-2-carboxamide
N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(propan-2-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V027-9859 |
| Compound Name: | N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(propan-2-yl)thiophene-2-carboxamide |
| Molecular Weight: | 523.65 |
| Molecular Formula: | C27 H33 N5 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)N(CC(N1CCCN(CC1)c1ccc(c2ccc(c(c2)OC)OC)nn1)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3622 |
| logD: | 3.2492 |
| logSw: | -3.5494 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.391 |
| InChI Key: | HJRZWNOCPVFIBB-UHFFFAOYSA-N |