1-(4-chlorophenyl)-5-[(3-nitrophenyl)methyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-5-[(3-nitrophenyl)methyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-chlorophenyl)-5-[(3-nitrophenyl)methyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C801-0329 |
| Compound Name: | 1-(4-chlorophenyl)-5-[(3-nitrophenyl)methyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 381.78 |
| Molecular Formula: | C18 H12 Cl N5 O3 |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)N1C=Nc2c(cnn2c2ccc(cc2)[Cl])C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.4428 |
| logD: | 3.4428 |
| logSw: | -3.8838 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.671 |
| InChI Key: | GWRMZVPCHJKWSN-UHFFFAOYSA-N |