5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-5-oxopentanoic acid
Chemical Structure Depiction of
5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-5-oxopentanoic acid
5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-5-oxopentanoic acid
Compound characteristics
| Compound ID: | Y204-2576 |
| Compound Name: | 5-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-5-oxopentanoic acid |
| Molecular Weight: | 306.38 |
| Molecular Formula: | C15 H18 N2 O3 S |
| Smiles: | C1CCc2c(C#N)c(NC(CCCC(O)=O)=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.9555 |
| logD: | -0.6417 |
| logSw: | -2.4059 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.874 |
| InChI Key: | SDTCKLROTYTSPK-UHFFFAOYSA-N |