N-(2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Chemical Structure Depiction of
N-(2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
N-(2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Compound characteristics
| Compound ID: | G751-4617 |
| Compound Name: | N-(2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide |
| Molecular Weight: | 429.95 |
| Molecular Formula: | C20 H16 Cl N3 O2 S2 |
| Smiles: | CCC(Nc1ccc2c(c1)sc(n2)SCC1=CC(c2cc(ccc2N1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.249 |
| logD: | 5.0366 |
| logSw: | -5.5066 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.992 |
| InChI Key: | ZYJWDKYMTPLINJ-UHFFFAOYSA-N |