4-(benzenesulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
4-(benzenesulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
4-(benzenesulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-1811 |
| Compound Name: | 4-(benzenesulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 486.93 |
| Molecular Formula: | C23 H19 Cl N2 O6 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(C1CN(c2cc(ccc2O1)[Cl])S(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4588 |
| logD: | 3.4588 |
| logSw: | -3.8314 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.92 |
| InChI Key: | WEUFZZAOEQKMCK-JOCHJYFZSA-N |