6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D077-0398 |
| Compound Name: | 6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 464.48 |
| Molecular Formula: | C24 H24 N4 O6 |
| Smiles: | CN1C(c2c(cn(CCc3ccc(c(c3)OC)OC)c2c2cccc(c2)[N+]([O-])=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3205 |
| logD: | 3.3205 |
| logSw: | -3.6305 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.949 |
| InChI Key: | GDNSMFVRJSTPEB-UHFFFAOYSA-N |