N-(3-chloro-4-fluorophenyl)-2-[(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-[(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
N-(3-chloro-4-fluorophenyl)-2-[(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F798-0164 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-[(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide |
| Molecular Weight: | 451.93 |
| Molecular Formula: | C18 H15 Cl F N5 O2 S2 |
| Smiles: | CCCN1C(c2c(ccs2)n2c1nnc2SCC(Nc1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.025 |
| logD: | 4.0184 |
| logSw: | -4.3139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.73 |
| InChI Key: | RNFCVYQYQBWPMM-UHFFFAOYSA-N |