3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(4-propoxyphenyl)propanoic acid
Chemical Structure Depiction of
3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(4-propoxyphenyl)propanoic acid
3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(4-propoxyphenyl)propanoic acid
Compound characteristics
| Compound ID: | 8016-6959 |
| Compound Name: | 3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(4-propoxyphenyl)propanoic acid |
| Molecular Weight: | 417.91 |
| Molecular Formula: | C21 H20 Cl N O4 S |
| Smiles: | CCCOc1ccc(cc1)C(CC(O)=O)NC(c1c(c2ccccc2s1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0683 |
| logD: | 2.4306 |
| logSw: | -4.8177 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.831 |
| InChI Key: | RNRQDNIUQFKRIJ-INIZCTEOSA-N |