methyl 2-[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]-5-propyl-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]-5-propyl-1,3-thiazole-4-carboxylate
methyl 2-[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]-5-propyl-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | J103-0219 |
| Compound Name: | methyl 2-[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]-5-propyl-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C18 H22 N4 O4 S |
| Smiles: | CCCc1c(C(=O)OC)nc(NC(CN2C(C=C3CCCCC3=N2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.9099 |
| logD: | 2.8885 |
| logSw: | -3.2212 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.373 |
| InChI Key: | DGGLOHZCQQPALJ-UHFFFAOYSA-N |