1-tert-butyl-5-[(3-chlorophenyl)methyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-tert-butyl-5-[(3-chlorophenyl)methyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-tert-butyl-5-[(3-chlorophenyl)methyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C801-0673 |
| Compound Name: | 1-tert-butyl-5-[(3-chlorophenyl)methyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 316.79 |
| Molecular Formula: | C16 H17 Cl N4 O |
| Smiles: | CC(C)(C)n1c2c(cn1)C(N(Cc1cccc(c1)[Cl])C=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0888 |
| logD: | 3.0888 |
| logSw: | -3.4211 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.256 |
| InChI Key: | TURJZDHPKKLVTA-UHFFFAOYSA-N |