5-{[3-(cyclopropylcarbamoyl)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-3-methyl-5-oxopentanoic acid
Chemical Structure Depiction of
5-{[3-(cyclopropylcarbamoyl)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-3-methyl-5-oxopentanoic acid
5-{[3-(cyclopropylcarbamoyl)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-3-methyl-5-oxopentanoic acid
Compound characteristics
| Compound ID: | Y205-7771 |
| Compound Name: | 5-{[3-(cyclopropylcarbamoyl)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-3-methyl-5-oxopentanoic acid |
| Molecular Weight: | 434.6 |
| Molecular Formula: | C23 H34 N2 O4 S |
| Smiles: | CCC(C)(C)C1CCc2c(C(NC3CC3)=O)c(NC(CC(C)CC(O)=O)=O)sc2C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5102 |
| logD: | 0.9437 |
| logSw: | -3.7197 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.956 |
| InChI Key: | BCSRAGDDMONZKN-UHFFFAOYSA-N |