ethyl (1-{[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}cyclohexyl)acetate
Chemical Structure Depiction of
ethyl (1-{[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}cyclohexyl)acetate
ethyl (1-{[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}cyclohexyl)acetate
Compound characteristics
| Compound ID: | F924-0432 |
| Compound Name: | ethyl (1-{[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}cyclohexyl)acetate |
| Molecular Weight: | 481.62 |
| Molecular Formula: | C25 H31 N5 O3 S |
| Smiles: | CCOC(CC1(CCCCC1)NC(N1CCC2=C(C1)Sc1nc(c3ccc(C)cc3)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7278 |
| logD: | 4.7278 |
| logSw: | -4.2031 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.747 |
| InChI Key: | YJGJDRHNBCMEIQ-UHFFFAOYSA-N |