4-(2-methyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzoic acid
Chemical Structure Depiction of
4-(2-methyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzoic acid
4-(2-methyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzoic acid
Compound characteristics
| Compound ID: | C795-1490 |
| Compound Name: | 4-(2-methyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl)benzoic acid |
| Molecular Weight: | 269.34 |
| Molecular Formula: | C17 H19 N O2 |
| Smiles: | Cc1cc2CCCCCc2n1c1ccc(cc1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1093 |
| logD: | 1.2231 |
| logSw: | -4.0636 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.5477 |
| InChI Key: | GHFQGKGCAPQKPZ-UHFFFAOYSA-N |