N-[3-chloro-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[3-chloro-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide
N-[3-chloro-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4234-0091 |
| Compound Name: | N-[3-chloro-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 351.85 |
| Molecular Formula: | C17 H18 Cl N O3 S |
| Smiles: | CC(C)C1=C/C(C(C)=C(C1=O)[Cl])=N/S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6526 |
| logD: | 4.6526 |
| logSw: | -4.7323 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.528 |
| InChI Key: | WRWRNLJDEPGTRT-UHFFFAOYSA-N |