N-(5-bromo-2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-(5-bromo-2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methylbenzene-1-sulfonamide
N-(5-bromo-2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 3993-4582 |
| Compound Name: | N-(5-bromo-2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 354.22 |
| Molecular Formula: | C14 H12 Br N O3 S |
| Smiles: | CC1=CC(C(=C/C1=N/S(c1ccc(C)cc1)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4294 |
| logD: | 3.4294 |
| logSw: | -3.6684 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.629 |
| InChI Key: | MVHIKDNMJUQHPU-UHFFFAOYSA-N |