4-methyl-3-(1H-pyrrol-1-yl)benzoic acid
Chemical Structure Depiction of
4-methyl-3-(1H-pyrrol-1-yl)benzoic acid
4-methyl-3-(1H-pyrrol-1-yl)benzoic acid
Compound characteristics
| Compound ID: | 6414-0397 |
| Compound Name: | 4-methyl-3-(1H-pyrrol-1-yl)benzoic acid |
| Molecular Weight: | 201.22 |
| Molecular Formula: | C12 H11 N O2 |
| Smiles: | Cc1ccc(cc1n1cccc1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2739 |
| logD: | -0.9392 |
| logSw: | -3.1691 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.332 |
| InChI Key: | OFNPBYYSTKWMRV-UHFFFAOYSA-N |