ethyl 3-{4-[3-(thiophene-2-sulfonyl)propanamido]benzamido}benzoate
Chemical Structure Depiction of
ethyl 3-{4-[3-(thiophene-2-sulfonyl)propanamido]benzamido}benzoate
ethyl 3-{4-[3-(thiophene-2-sulfonyl)propanamido]benzamido}benzoate
Compound characteristics
Compound ID: | C224-4900 |
Compound Name: | ethyl 3-{4-[3-(thiophene-2-sulfonyl)propanamido]benzamido}benzoate |
Molecular Weight: | 486.56 |
Molecular Formula: | C23 H22 N2 O6 S2 |
Smiles: | CCOC(c1cccc(c1)NC(c1ccc(cc1)NC(CCS(c1cccs1)(=O)=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6186 |
logD: | 3.6177 |
logSw: | -3.8765 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 97.016 |
InChI Key: | LAVIWMFBJJUAMC-UHFFFAOYSA-N |