6-[3-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione
Chemical Structure Depiction of
6-[3-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione
6-[3-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione
Compound characteristics
| Compound ID: | K906-4581 |
| Compound Name: | 6-[3-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione |
| Molecular Weight: | 443.48 |
| Molecular Formula: | C21 H21 N3 O6 S |
| Smiles: | CN1C(C(N(C)c2cc(ccc12)S(CCC(N1CCOc2ccccc12)=O)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5338 |
| logD: | 0.5338 |
| logSw: | -2.2111 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.371 |
| InChI Key: | YMUKIKCYMJAGLJ-UHFFFAOYSA-N |