1-(4-chlorophenyl)-N-[(4-ethylphenyl)methyl]-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
1-(4-chlorophenyl)-N-[(4-ethylphenyl)methyl]-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
1-(4-chlorophenyl)-N-[(4-ethylphenyl)methyl]-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | L090-0567 |
| Compound Name: | 1-(4-chlorophenyl)-N-[(4-ethylphenyl)methyl]-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 421.88 |
| Molecular Formula: | C22 H20 Cl N5 O2 |
| Smiles: | CCc1ccc(CNC(c2c3c(C(N(C)C=N3)=O)n(c3ccc(cc3)[Cl])n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0716 |
| logD: | 3.0711 |
| logSw: | -3.5346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.739 |
| InChI Key: | LWNBLLLDDODSNU-UHFFFAOYSA-N |