5-[(2,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
Chemical Structure Depiction of
5-[(2,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
5-[(2,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
Compound characteristics
| Compound ID: | D112-0109 |
| Compound Name: | 5-[(2,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine |
| Molecular Weight: | 452.34 |
| Molecular Formula: | C22 H19 Cl2 N7 |
| Smiles: | Cn1c2c(c(NCCc3c[nH]c4ccccc34)nc(Cc3ccc(cc3[Cl])[Cl])n2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 5.1609 |
| logD: | 5.1608 |
| logSw: | -5.7459 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.728 |
| InChI Key: | ILHGNSCTJVLAEJ-UHFFFAOYSA-N |