ethyl 4-{[2-(4-tert-butylphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[2-(4-tert-butylphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetyl}piperazine-1-carboxylate
ethyl 4-{[2-(4-tert-butylphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D458-0395 |
| Compound Name: | ethyl 4-{[2-(4-tert-butylphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetyl}piperazine-1-carboxylate |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C26 H34 N6 O3 |
| Smiles: | CCOC(N1CCN(CC1)C(Cc1c(C)nc2nc(c3ccc(cc3)C(C)(C)C)nn2c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.273 |
| logD: | 4.2729 |
| logSw: | -4.2328 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.006 |
| InChI Key: | MEDQUTICSBMYJO-UHFFFAOYSA-N |