3-[3-(3-cyanopropoxy)-4-methoxyphenyl]benzo[f]quinoline-1-carboxylic acid
Chemical Structure Depiction of
3-[3-(3-cyanopropoxy)-4-methoxyphenyl]benzo[f]quinoline-1-carboxylic acid
3-[3-(3-cyanopropoxy)-4-methoxyphenyl]benzo[f]quinoline-1-carboxylic acid
Compound characteristics
| Compound ID: | 8013-9329 |
| Compound Name: | 3-[3-(3-cyanopropoxy)-4-methoxyphenyl]benzo[f]quinoline-1-carboxylic acid |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C25 H20 N2 O4 |
| Smiles: | COc1ccc(cc1OCCCC#N)c1cc(C(O)=O)c2c3ccccc3ccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5494 |
| logD: | -0.4461 |
| logSw: | -4.9297 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.061 |
| InChI Key: | ZQJWWRMMYASGQE-UHFFFAOYSA-N |