4-(benzenesulfonyl)-6-tert-butyl-N-[(2-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
4-(benzenesulfonyl)-6-tert-butyl-N-[(2-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
4-(benzenesulfonyl)-6-tert-butyl-N-[(2-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-1681 |
| Compound Name: | 4-(benzenesulfonyl)-6-tert-butyl-N-[(2-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 499.03 |
| Molecular Formula: | C26 H27 Cl N2 O4 S |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(CC(C(NCc1ccccc1[Cl])=O)O2)S(c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3466 |
| logD: | 5.3466 |
| logSw: | -5.8374 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.805 |
| InChI Key: | KQBZWMZVXBLWJQ-DEOSSOPVSA-N |