6-(2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-(2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-one
6-(2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | 8018-6582 |
| Compound Name: | 6-(2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 362.42 |
| Molecular Formula: | C16 H14 N2 O4 S2 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCOc2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0891 |
| logD: | 3.0891 |
| logSw: | -3.5591 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.952 |
| InChI Key: | BWHCHSJGXLXPME-UHFFFAOYSA-N |