ethyl 3-{7-[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{7-[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
ethyl 3-{7-[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Compound characteristics
| Compound ID: | V011-2549 |
| Compound Name: | ethyl 3-{7-[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C20 H27 N7 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(CCc1c(C)nc2ncnn2c1N1CCN(CC1)S(c1c(C)noc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2514 |
| logD: | 1.222 |
| logSw: | -1.8484 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 108.291 |
| InChI Key: | PGVYUQPEBOBUAW-UHFFFAOYSA-N |