6-methyl-4-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
6-methyl-4-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
6-methyl-4-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-1907 |
| Compound Name: | 6-methyl-4-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C25 H26 N2 O4 S |
| Smiles: | Cc1ccc(CNC(C2CN(c3cc(C)ccc3O2)S(c2ccc(C)cc2)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4529 |
| logD: | 4.4528 |
| logSw: | -4.3372 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.805 |
| InChI Key: | KYUKYIIBMPCYPY-XMMPIXPASA-N |