ethyl 2-{[2-(4-chlorophenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[2-(4-chlorophenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carbonyl]amino}benzoate
ethyl 2-{[2-(4-chlorophenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | F924-0194 |
| Compound Name: | ethyl 2-{[2-(4-chlorophenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carbonyl]amino}benzoate |
| Molecular Weight: | 481.96 |
| Molecular Formula: | C23 H20 Cl N5 O3 S |
| Smiles: | CCOC(c1ccccc1NC(N1CCC2=C(C1)Sc1nc(c3ccc(cc3)[Cl])nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3213 |
| logD: | 5.3193 |
| logSw: | -5.8386 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.28 |
| InChI Key: | OQMZFVVGMFKHRI-UHFFFAOYSA-N |