N-(cyclohexylmethyl)-5-[(2,4-dichlorophenyl)methyl]-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
Chemical Structure Depiction of
N-(cyclohexylmethyl)-5-[(2,4-dichlorophenyl)methyl]-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
N-(cyclohexylmethyl)-5-[(2,4-dichlorophenyl)methyl]-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
Compound characteristics
| Compound ID: | D112-0124 |
| Compound Name: | N-(cyclohexylmethyl)-5-[(2,4-dichlorophenyl)methyl]-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine |
| Molecular Weight: | 405.33 |
| Molecular Formula: | C19 H22 Cl2 N6 |
| Smiles: | Cn1c2c(c(NCC3CCCCC3)nc(Cc3ccc(cc3[Cl])[Cl])n2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 5.4425 |
| logD: | 5.4424 |
| logSw: | -5.9477 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.208 |
| InChI Key: | XBCMJEIUWWBUDU-UHFFFAOYSA-N |