ethyl 4-[3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
Chemical Structure Depiction of
ethyl 4-[3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
ethyl 4-[3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | C561-1866 |
| Compound Name: | ethyl 4-[3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C20 H23 N5 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC(CCc1c(C)nc2nc(C)nn2c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4336 |
| logD: | 2.433 |
| logSw: | -2.783 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.62 |
| InChI Key: | SPBSCGCYBCFRLG-UHFFFAOYSA-N |