methyl 6-({2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}amino)hexanoate
Chemical Structure Depiction of
methyl 6-({2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}amino)hexanoate
methyl 6-({2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}amino)hexanoate
Compound characteristics
| Compound ID: | D245-0631 |
| Compound Name: | methyl 6-({2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}amino)hexanoate |
| Molecular Weight: | 401.89 |
| Molecular Formula: | C20 H24 Cl N5 O2 |
| Smiles: | Cc1cc(NCCCCCC(=O)OC)n2c(n1)nc(Cc1ccc(cc1)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 3.4778 |
| logD: | 3.4554 |
| logSw: | -3.8788 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.845 |
| InChI Key: | UXROFMKHTSBSTJ-UHFFFAOYSA-N |