N-{2-[ethyl(phenyl)amino]ethyl}-1-methyl-4-(thiomorpholin-4-yl)-1H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-{2-[ethyl(phenyl)amino]ethyl}-1-methyl-4-(thiomorpholin-4-yl)-1H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
N-{2-[ethyl(phenyl)amino]ethyl}-1-methyl-4-(thiomorpholin-4-yl)-1H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | P857-0953 |
| Compound Name: | N-{2-[ethyl(phenyl)amino]ethyl}-1-methyl-4-(thiomorpholin-4-yl)-1H-pyrazolo[3,4-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C21 H27 N7 O S |
| Smiles: | CCN(CCNC(c1nc(c2cnn(C)c2n1)N1CCSCC1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7363 |
| logD: | 2.7322 |
| logSw: | -3.0298 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.288 |
| InChI Key: | NOEWGGWDWJKKDY-UHFFFAOYSA-N |