methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]thiophene-3-carboxylate
methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y505-2791 |
| Compound Name: | methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]thiophene-3-carboxylate |
| Molecular Weight: | 402.43 |
| Molecular Formula: | C17 H18 N6 O4 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(c2cc(C)nc3ncnn23)=O)sc1C(N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2587 |
| logD: | -2.72 |
| logSw: | -2.2858 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.86 |
| InChI Key: | AJRIAQYZPAMTOH-UHFFFAOYSA-N |