6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,4-dimethyl-7-nitro-1,4-dihydroquinoxaline-2,3-dione
Chemical Structure Depiction of
6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,4-dimethyl-7-nitro-1,4-dihydroquinoxaline-2,3-dione
6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,4-dimethyl-7-nitro-1,4-dihydroquinoxaline-2,3-dione
Compound characteristics
| Compound ID: | 8018-0649 |
| Compound Name: | 6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,4-dimethyl-7-nitro-1,4-dihydroquinoxaline-2,3-dione |
| Molecular Weight: | 384.35 |
| Molecular Formula: | C18 H16 N4 O6 |
| Smiles: | CN1C(C(N(C)c2cc(c(cc12)NCc1ccc2c(c1)OCO2)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7965 |
| logD: | 1.7965 |
| logSw: | -2.4029 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.331 |
| InChI Key: | ALRSCVMYAZIHNF-UHFFFAOYSA-N |