N-[3-(butylsulfanyl)propyl]-3-[3-(4-methylphenyl)-6-oxo-5,6-dihydropyridazin-1(4H)-yl]propanamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-3-[3-(4-methylphenyl)-6-oxo-5,6-dihydropyridazin-1(4H)-yl]propanamide
N-[3-(butylsulfanyl)propyl]-3-[3-(4-methylphenyl)-6-oxo-5,6-dihydropyridazin-1(4H)-yl]propanamide
Compound characteristics
| Compound ID: | K788-0740 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-3-[3-(4-methylphenyl)-6-oxo-5,6-dihydropyridazin-1(4H)-yl]propanamide |
| Molecular Weight: | 389.56 |
| Molecular Formula: | C21 H31 N3 O2 S |
| Smiles: | CCCCSCCCNC(CCN1C(CCC(c2ccc(C)cc2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0644 |
| logD: | 2.9961 |
| logSw: | -3.2127 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.11 |
| InChI Key: | XUNJIGAQQAAEHP-UHFFFAOYSA-N |