rel-(5R,7S)-5-(2,4-dichlorophenyl)-7-(3-methoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Chemical Structure Depiction of
rel-(5R,7S)-5-(2,4-dichlorophenyl)-7-(3-methoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
rel-(5R,7S)-5-(2,4-dichlorophenyl)-7-(3-methoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Compound characteristics
| Compound ID: | 6321-0444 |
| Compound Name: | rel-(5R,7S)-5-(2,4-dichlorophenyl)-7-(3-methoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-amine |
| Molecular Weight: | 390.27 |
| Molecular Formula: | C18 H17 Cl2 N5 O |
| Smiles: | COc1cccc(c1)[C@H]1C[C@@H](c2ccc(cc2[Cl])[Cl])Nc2nc(N)nn12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.4588 |
| logD: | 4.3721 |
| logSw: | -4.4997 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.138 |
| InChI Key: | SSOOJTXYAKGYSR-HZPDHXFCSA-N |