methyl 5-ethyl-7-(thiophen-2-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-ethyl-7-(thiophen-2-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
methyl 5-ethyl-7-(thiophen-2-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 8016-3208 |
| Compound Name: | methyl 5-ethyl-7-(thiophen-2-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 290.34 |
| Molecular Formula: | C13 H14 N4 O2 S |
| Smiles: | CCC1=C(C(c2cccs2)n2c(N1)ncn2)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2233 |
| logD: | 1.6928 |
| logSw: | -2.7784 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.789 |
| InChI Key: | WBHQAJCPWVJKNJ-NSHDSACASA-N |