3-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)-N-(2-methoxy-4-nitrophenyl)propanamide
Chemical Structure Depiction of
3-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)-N-(2-methoxy-4-nitrophenyl)propanamide
3-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)-N-(2-methoxy-4-nitrophenyl)propanamide
Compound characteristics
| Compound ID: | K906-4571 |
| Compound Name: | 3-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)-N-(2-methoxy-4-nitrophenyl)propanamide |
| Molecular Weight: | 476.46 |
| Molecular Formula: | C20 H20 N4 O8 S |
| Smiles: | CN1C(C(N(C)c2cc(ccc12)S(CCC(Nc1ccc(cc1OC)[N+]([O-])=O)=O)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4165 |
| logD: | 0.1111 |
| logSw: | -2.4831 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 122.826 |
| InChI Key: | BQQZHOMLJCPJMY-UHFFFAOYSA-N |