1-methyl-4-(3-nitrophenyl)-6-(propan-2-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
1-methyl-4-(3-nitrophenyl)-6-(propan-2-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
1-methyl-4-(3-nitrophenyl)-6-(propan-2-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | 8018-2802 |
| Compound Name: | 1-methyl-4-(3-nitrophenyl)-6-(propan-2-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 330.34 |
| Molecular Formula: | C16 H18 N4 O4 |
| Smiles: | CC(C)N1CC2=C(C(c3cccc(c3)[N+]([O-])=O)NC(N2C)=O)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5647 |
| logD: | 1.1107 |
| logSw: | -2.4281 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.042 |
| InChI Key: | BIOULNFRCZLJEL-CQSZACIVSA-N |