6-[3-(6-chloro-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-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione
6-[3-(6-chloro-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: | K906-4577 |
| Compound Name: | 6-[3-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-3-oxopropane-1-sulfonyl]-1,4-dimethyl-1,4-dihydroquinoxaline-2,3-dione |
| Molecular Weight: | 477.92 |
| Molecular Formula: | C21 H20 Cl N3 O6 S |
| Smiles: | CN1C(C(N(C)c2cc(ccc12)S(CCC(N1CCOc2ccc(cc12)[Cl])=O)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1491 |
| logD: | 1.1491 |
| logSw: | -2.7894 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.371 |
| InChI Key: | ZIFAMOPPULBCGI-UHFFFAOYSA-N |