N-[5,7-bis(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thiophene-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[5,7-bis(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thiophene-2-carboxamide--hydrogen chloride (1/1)
N-[5,7-bis(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thiophene-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D413-0165 |
| Compound Name: | N-[5,7-bis(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thiophene-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 504.82 |
| Molecular Formula: | C22 H15 Cl2 N5 O S |
| Salt: | HCl |
| Smiles: | C1C(c2ccc(cc2)[Cl])n2c(NC=1c1ccc(cc1)[Cl])nc(NC(c1cccs1)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1497 |
| logD: | 6.1425 |
| logSw: | -6.5647 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.903 |
| InChI Key: | DLIXELPJURWQRD-SFHVURJKSA-N |