5-oxo-5-{[3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}pentanoic acid
Chemical Structure Depiction of
5-oxo-5-{[3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}pentanoic acid
5-oxo-5-{[3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}pentanoic acid
Compound characteristics
| Compound ID: | Y200-5961 |
| Compound Name: | 5-oxo-5-{[3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}pentanoic acid |
| Molecular Weight: | 353.44 |
| Molecular Formula: | C17 H23 N O5 S |
| Smiles: | CCCOC(c1c2CCCCc2sc1NC(CCCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4337 |
| logD: | -0.1635 |
| logSw: | -2.5712 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.534 |
| InChI Key: | JYWLMZSDTNKLMI-UHFFFAOYSA-N |