4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-[3-(propylsulfanyl)propyl]butanamide
Chemical Structure Depiction of
4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-[3-(propylsulfanyl)propyl]butanamide
4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-[3-(propylsulfanyl)propyl]butanamide
Compound characteristics
| Compound ID: | C884-2818 |
| Compound Name: | 4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-[3-(propylsulfanyl)propyl]butanamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C21 H28 N4 O2 S |
| Smiles: | CCCSCCCNC(CCCn1c2C(N(C)N=Cc2c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.799 |
| logD: | 1.7986 |
| logSw: | -2.2957 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.585 |
| InChI Key: | YNARQCZNAXJVEX-UHFFFAOYSA-N |