N-(3-chloro-4-fluorophenyl)-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
N-(3-chloro-4-fluorophenyl)-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C201-1158 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 447.94 |
| Molecular Formula: | C19 H15 Cl F N5 O S2 |
| Smiles: | C1CCc2c(C1)c1c3nnc(n3C=Nc1s2)SCC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1953 |
| logD: | 4.1886 |
| logSw: | -4.8054 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.984 |
| InChI Key: | ZFGMAUYMCWVQQI-UHFFFAOYSA-N |