methyl 2-[([1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[([1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
methyl 2-[([1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6466-1253 |
| Compound Name: | methyl 2-[([1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 343.36 |
| Molecular Formula: | C15 H13 N5 O3 S |
| Smiles: | COC(c1c2CCCc2sc1NC(c1nc2ncccn2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1387 |
| logD: | -2.4697 |
| logSw: | -2.2454 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.202 |
| InChI Key: | PMBIDMKSDWOTCS-UHFFFAOYSA-N |