3-[4-(cyclopentyloxy)phenyl]-3-(3-methyl-2-nitrobenzamido)propanoic acid
Chemical Structure Depiction of
3-[4-(cyclopentyloxy)phenyl]-3-(3-methyl-2-nitrobenzamido)propanoic acid
3-[4-(cyclopentyloxy)phenyl]-3-(3-methyl-2-nitrobenzamido)propanoic acid
Compound characteristics
| Compound ID: | 8015-5840 |
| Compound Name: | 3-[4-(cyclopentyloxy)phenyl]-3-(3-methyl-2-nitrobenzamido)propanoic acid |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C22 H24 N2 O6 |
| Smiles: | Cc1cccc(C(NC(CC(O)=O)c2ccc(cc2)OC2CCCC2)=O)c1[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9849 |
| logD: | 1.3472 |
| logSw: | -4.2832 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.265 |
| InChI Key: | KSPNMOPONVIHLY-IBGZPJMESA-N |