methyl 2-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]-5-(3-fluorophenyl)-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 2-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]-5-(3-fluorophenyl)-1,3-thiazole-4-carboxylate
methyl 2-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]-5-(3-fluorophenyl)-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y042-6088 |
| Compound Name: | methyl 2-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]-5-(3-fluorophenyl)-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 454.48 |
| Molecular Formula: | C21 H19 F N6 O3 S |
| Smiles: | Cc1c(CCC(Nc2nc(C(=O)OC)c(c3cccc(c3)F)s2)=O)c(C)n2c(ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9648 |
| logD: | 2.9641 |
| logSw: | -3.4635 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.914 |
| InChI Key: | WXNZCCPUFCSULR-UHFFFAOYSA-N |