N-(2-{[(6,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Chemical Structure Depiction of
N-(2-{[(6,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
N-(2-{[(6,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Compound characteristics
| Compound ID: | G751-3561 |
| Compound Name: | N-(2-{[(6,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide |
| Molecular Weight: | 423.55 |
| Molecular Formula: | C22 H21 N3 O2 S2 |
| Smiles: | CCC(Nc1ccc2c(c1)sc(n2)SCC1=CC(c2cc(C)cc(C)c2N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9041 |
| logD: | 4.8942 |
| logSw: | -4.5744 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.74 |
| InChI Key: | DEQSPRZRNHPVHG-UHFFFAOYSA-N |