methyl N-(4-acetyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3,5-dimethylphenyl)glycinate
Chemical Structure Depiction of
methyl N-(4-acetyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3,5-dimethylphenyl)glycinate
methyl N-(4-acetyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3,5-dimethylphenyl)glycinate
Compound characteristics
| Compound ID: | K906-4113 |
| Compound Name: | methyl N-(4-acetyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3,5-dimethylphenyl)glycinate |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C22 H26 N2 O6 S |
| Smiles: | CC(N1CCOc2cc(c(C)cc12)S(N(CC(=O)OC)c1cc(C)cc(C)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.183 |
| logD: | 3.183 |
| logSw: | -3.4377 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.646 |
| InChI Key: | VXDAEMMRSXLBSO-UHFFFAOYSA-N |