4-methyl-N-{4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-methyl-N-{4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}benzene-1-sulfonamide
4-methyl-N-{4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | D487-0129 |
| Compound Name: | 4-methyl-N-{4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}benzene-1-sulfonamide |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C21 H19 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(Nc1nc(cs1)c1ccc2c(c1)N(CC=C)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1148 |
| logD: | 3.9807 |
| logSw: | -4.2735 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.743 |
| InChI Key: | LMGSHALHCNPIIZ-UHFFFAOYSA-N |