6-chloro-3-(4-methylbenzene-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-chloro-3-(4-methylbenzene-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
6-chloro-3-(4-methylbenzene-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | 0469-0703 |
| Compound Name: | 6-chloro-3-(4-methylbenzene-1-sulfonyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 323.75 |
| Molecular Formula: | C14 H10 Cl N O4 S |
| Smiles: | Cc1ccc(cc1)S(N1C(=O)Oc2cc(ccc12)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.692 |
| logD: | 3.692 |
| logSw: | -4.2676 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.268 |
| InChI Key: | KEMHGMJWDGMRJI-UHFFFAOYSA-N |