2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | G751-5399 |
| Compound Name: | 2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 400.93 |
| Molecular Formula: | C21 H21 Cl N2 O2 S |
| Smiles: | CC(C)c1ccc(cc1)NC(CSCC1=CC(c2cc(ccc2N1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7316 |
| logD: | 5.4995 |
| logSw: | -6.0363 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.911 |
| InChI Key: | IBXKQZVVUGGKNO-UHFFFAOYSA-N |