N-[(4-chlorophenyl)methyl]-2-methyl-4-(thiomorpholin-4-yl)-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-methyl-4-(thiomorpholin-4-yl)-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
N-[(4-chlorophenyl)methyl]-2-methyl-4-(thiomorpholin-4-yl)-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | T491-0505 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-methyl-4-(thiomorpholin-4-yl)-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 402.9 |
| Molecular Formula: | C18 H19 Cl N6 O S |
| Smiles: | Cn1cc2c(nc(C(NCc3ccc(cc3)[Cl])=O)nc2n1)N1CCSCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.737 |
| logD: | 2.737 |
| logSw: | -3.5432 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.235 |
| InChI Key: | UUFWIAPUNOLJFL-UHFFFAOYSA-N |