5-[(benzylamino)methyl]-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-[(benzylamino)methyl]-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
5-[(benzylamino)methyl]-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D351-0413 |
| Compound Name: | 5-[(benzylamino)methyl]-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 381.86 |
| Molecular Formula: | C20 H19 N5 O |
| Salt: | HCl |
| Smiles: | Cc1ccccc1c1nc2NC(CNCc3ccccc3)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7732 |
| logD: | 1.9788 |
| logSw: | -3.4316 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.106 |
| InChI Key: | RDNCROFBBUKNLY-UHFFFAOYSA-N |