1-[4-(azepane-1-sulfonyl)phenyl]-5-oxopyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
1-[4-(azepane-1-sulfonyl)phenyl]-5-oxopyrrolidine-3-carboxylic acid
1-[4-(azepane-1-sulfonyl)phenyl]-5-oxopyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | Y041-8872 |
| Compound Name: | 1-[4-(azepane-1-sulfonyl)phenyl]-5-oxopyrrolidine-3-carboxylic acid |
| Molecular Weight: | 366.43 |
| Molecular Formula: | C17 H22 N2 O5 S |
| Smiles: | C1CCCN(CC1)S(c1ccc(cc1)N1CC(CC1=O)C(O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0607 |
| logD: | -1.2997 |
| logSw: | -2.3884 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.438 |
| InChI Key: | MZPNBKFVGRQJDX-CYBMUJFWSA-N |