N-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methylbenzene-1-sulfonamide
N-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 1431-0033 |
| Compound Name: | N-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 419.09 |
| Molecular Formula: | C13 H9 Br2 N O3 S |
| Smiles: | Cc1ccc(cc1)S(N=C1C=C(C(C(=C1)[Br])=O)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6725 |
| logD: | 3.6725 |
| logSw: | -3.8008 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.263 |
| InChI Key: | BXAQBYFIQWKQFB-UHFFFAOYSA-N |