5-{[3-(benzylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino}-5-oxopentanoic acid
Chemical Structure Depiction of
5-{[3-(benzylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino}-5-oxopentanoic acid
5-{[3-(benzylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino}-5-oxopentanoic acid
Compound characteristics
| Compound ID: | Y200-3914 |
| Compound Name: | 5-{[3-(benzylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino}-5-oxopentanoic acid |
| Molecular Weight: | 414.52 |
| Molecular Formula: | C22 H26 N2 O4 S |
| Smiles: | C1CCc2c(C(NCc3ccccc3)=O)c(NC(CCCC(O)=O)=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.8592 |
| logD: | 0.2621 |
| logSw: | -3.4847 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.231 |
| InChI Key: | SQDJNNHZBLJCFT-UHFFFAOYSA-N |