N-(3-chloro-2-methylphenyl)-2-[(3-ethyl-1,6-diphenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]propanamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[(3-ethyl-1,6-diphenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]propanamide
N-(3-chloro-2-methylphenyl)-2-[(3-ethyl-1,6-diphenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]propanamide
Compound characteristics
| Compound ID: | F569-0447 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[(3-ethyl-1,6-diphenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]propanamide |
| Molecular Weight: | 528.08 |
| Molecular Formula: | C29 H26 Cl N5 O S |
| Smiles: | CCc1c2c(nc(c3ccccc3)nc2n(c2ccccc2)n1)SC(C)C(Nc1cccc(c1C)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.0953 |
| logD: | 8.0948 |
| logSw: | -6.5389 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.532 |
| InChI Key: | USCZAALDCLKHKY-IBGZPJMESA-N |