ethyl 1-{2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidine-4-carboxylate
ethyl 1-{2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | D245-0599 |
| Compound Name: | ethyl 1-{2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperidine-4-carboxylate |
| Molecular Weight: | 413.91 |
| Molecular Formula: | C21 H24 Cl N5 O2 |
| Smiles: | CCOC(C1CCN(CC1)c1cc(C)nc2nc(Cc3ccc(cc3)[Cl])nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0599 |
| logD: | 3.989 |
| logSw: | -4.2845 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.861 |
| InChI Key: | KSXDQDQDHMCMKW-UHFFFAOYSA-N |