ethyl 4-[(6-methyl-7-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(6-methyl-7-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonyl)amino]benzoate
ethyl 4-[(6-methyl-7-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | L090-2091 |
| Compound Name: | ethyl 4-[(6-methyl-7-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonyl)amino]benzoate |
| Molecular Weight: | 417.42 |
| Molecular Formula: | C22 H19 N5 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1c2c(C(N(C)C=N2)=O)n(c2ccccc2)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4348 |
| logD: | 2.3718 |
| logSw: | -2.8118 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.171 |
| InChI Key: | IKNBNTHPNGJXTN-UHFFFAOYSA-N |