N-(3-chloro-4-fluorophenyl)-2-(8,9-dimethyl-3-oxothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-(8,9-dimethyl-3-oxothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
N-(3-chloro-4-fluorophenyl)-2-(8,9-dimethyl-3-oxothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F815-0213 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-(8,9-dimethyl-3-oxothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide |
| Molecular Weight: | 405.84 |
| Molecular Formula: | C17 H13 Cl F N5 O2 S |
| Smiles: | Cc1c2C3=NN(CC(Nc4ccc(c(c4)[Cl])F)=O)C(N3C=Nc2sc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4912 |
| logD: | 3.4888 |
| logSw: | -4.2531 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.739 |
| InChI Key: | URPRHBWUGQHZPS-UHFFFAOYSA-N |