1,4-dimethyl-6-[3-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dihydroquinoxaline-2,3-dione
Chemical Structure Depiction of
1,4-dimethyl-6-[3-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dihydroquinoxaline-2,3-dione
1,4-dimethyl-6-[3-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dihydroquinoxaline-2,3-dione
Compound characteristics
| Compound ID: | K906-4578 |
| Compound Name: | 1,4-dimethyl-6-[3-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dihydroquinoxaline-2,3-dione |
| Molecular Weight: | 457.5 |
| Molecular Formula: | C22 H23 N3 O6 S |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CCS(c1ccc2c(c1)N(C)C(C(N2C)=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0245 |
| logD: | 1.0245 |
| logSw: | -2.3274 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.371 |
| InChI Key: | FRCXABTYRHJLMT-UHFFFAOYSA-N |