ethyl [4-(cyclopentylcarbamoyl)-2-nitrobenzene-1-sulfonyl]acetate
Chemical Structure Depiction of
ethyl [4-(cyclopentylcarbamoyl)-2-nitrobenzene-1-sulfonyl]acetate
ethyl [4-(cyclopentylcarbamoyl)-2-nitrobenzene-1-sulfonyl]acetate
Compound characteristics
| Compound ID: | K781-9614 |
| Compound Name: | ethyl [4-(cyclopentylcarbamoyl)-2-nitrobenzene-1-sulfonyl]acetate |
| Molecular Weight: | 384.41 |
| Molecular Formula: | C16 H20 N2 O7 S |
| Smiles: | CCOC(CS(c1ccc(cc1[N+]([O-])=O)C(NC1CCCC1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2929 |
| logD: | 2.2929 |
| logSw: | -2.8208 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.019 |
| InChI Key: | CUTHKQHQXZLDPR-UHFFFAOYSA-N |