6-(4-amino-3,5-dichlorophenyl)-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
6-(4-amino-3,5-dichlorophenyl)-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
6-(4-amino-3,5-dichlorophenyl)-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D077-0410 |
| Compound Name: | 6-(4-amino-3,5-dichlorophenyl)-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 460.27 |
| Molecular Formula: | C20 H15 Cl2 N5 O4 |
| Smiles: | CN1C(c2c(cn(c3cc(c(c(c3)[Cl])N)[Cl])c2c2cccc(c2)[N+]([O-])=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3791 |
| logD: | 4.3791 |
| logSw: | -4.8253 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.555 |
| InChI Key: | ZZFHOJDUXNDJAJ-UHFFFAOYSA-N |