ethyl 4-{[2-(4-methylphenyl)-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 4-{[2-(4-methylphenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carbonyl]amino}benzoate
ethyl 4-{[2-(4-methylphenyl)-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: | F924-0390 |
| Compound Name: | ethyl 4-{[2-(4-methylphenyl)-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: | 461.54 |
| Molecular Formula: | C24 H23 N5 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCC2=C(C1)Sc1nc(c3ccc(C)cc3)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0871 |
| logD: | 5.0871 |
| logSw: | -4.7625 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.978 |
| InChI Key: | VWMMNHIPACAWFM-UHFFFAOYSA-N |