N-(2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-fluorobenzamide
N-(2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-fluorobenzamide
Compound characteristics
| Compound ID: | G751-4648 |
| Compound Name: | N-(2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-fluorobenzamide |
| Molecular Weight: | 495.98 |
| Molecular Formula: | C24 H15 Cl F N3 O2 S2 |
| Smiles: | C(C1=CC(c2cc(ccc2N1)[Cl])=O)Sc1nc2ccc(cc2s1)NC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4938 |
| logD: | 6.2813 |
| logSw: | -6.5344 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.934 |
| InChI Key: | JINFPCMJRMXMKK-UHFFFAOYSA-N |