prop-2-en-1-yl 2-{2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 2-{2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
prop-2-en-1-yl 2-{2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | D308-0247 |
| Compound Name: | prop-2-en-1-yl 2-{2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 483.57 |
| Molecular Formula: | C22 H21 N5 O4 S2 |
| Smiles: | Cc1cc2nnc(n2c2c(cccc12)OC)SCC(Nc1nc(C)c(C(=O)OCC=C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0729 |
| logD: | 4.033 |
| logSw: | -4.2744 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.309 |
| InChI Key: | OEFVKVPBBOASDA-UHFFFAOYSA-N |