N-(3-cyano-4,5-dimethylthiophen-2-yl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4,5-dimethylthiophen-2-yl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
N-(3-cyano-4,5-dimethylthiophen-2-yl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | Y505-2700 |
| Compound Name: | N-(3-cyano-4,5-dimethylthiophen-2-yl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide |
| Molecular Weight: | 374.42 |
| Molecular Formula: | C19 H14 N6 O S |
| Smiles: | Cc1c(C#N)c(NC(c2cc(c3ccccc3)nc3ncnn23)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 3.5018 |
| logD: | 1.9397 |
| logSw: | -4.0355 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.664 |
| InChI Key: | AQAFXXWUEMCQGQ-UHFFFAOYSA-N |