methyl 4-[2-(6-methyl-3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(6-methyl-3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]benzoate
methyl 4-[2-(6-methyl-3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | G835-0131 |
| Compound Name: | methyl 4-[2-(6-methyl-3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]benzoate |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C19 H21 N3 O4 |
| Smiles: | CC1CCC2C(C1)=CC(N(CC(Nc1ccc(cc1)C(=O)OC)=O)N=2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7776 |
| logD: | 2.7776 |
| logSw: | -3.3982 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.556 |
| InChI Key: | XYKPZKFJFWGRMY-GFCCVEGCSA-N |