N-{2,2,2-trichloro-1-[6-(piperidin-1-yl)-9H-purin-9-yl]ethyl}benzamide
Chemical Structure Depiction of
N-{2,2,2-trichloro-1-[6-(piperidin-1-yl)-9H-purin-9-yl]ethyl}benzamide
N-{2,2,2-trichloro-1-[6-(piperidin-1-yl)-9H-purin-9-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | 1492-0414 |
| Compound Name: | N-{2,2,2-trichloro-1-[6-(piperidin-1-yl)-9H-purin-9-yl]ethyl}benzamide |
| Molecular Weight: | 453.76 |
| Molecular Formula: | C19 H19 Cl3 N6 O |
| Smiles: | C1CCN(CC1)c1c2c(ncn1)n(cn2)C(C([Cl])([Cl])[Cl])NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2069 |
| logD: | 4.113 |
| logSw: | -4.4963 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.513 |
| InChI Key: | DPQJNYCYDRRRRA-SFHVURJKSA-N |