N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)-4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
Chemical Structure Depiction of
N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)-4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)-4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide
Compound characteristics
| Compound ID: | F249-0190 |
| Compound Name: | N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)-4-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)butanamide |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | CN1C(c2c(C=N1)c1ccccc1n2CCCC(NCCSCc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9556 |
| logD: | 1.9551 |
| logSw: | -2.3748 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.062 |
| InChI Key: | RVOTVIYYWVYKDV-UHFFFAOYSA-N |