1,3-dimethyl-6-{[(3-nitrophenyl)methylidene]amino}-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
1,3-dimethyl-6-{[(3-nitrophenyl)methylidene]amino}-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
1,3-dimethyl-6-{[(3-nitrophenyl)methylidene]amino}-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | 4861-0014 |
| Compound Name: | 1,3-dimethyl-6-{[(3-nitrophenyl)methylidene]amino}-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 403.4 |
| Molecular Formula: | C21 H17 N5 O4 |
| Smiles: | CN1C(c2c(cn(c2c2ccccc2)/N=C/c2cccc(c2)[N+]([O-])=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.994 |
| logD: | 2.994 |
| logSw: | -3.4344 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.447 |
| InChI Key: | YZSCIZCAUFYESE-UHFFFAOYSA-N |