methyl 4-[(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-[(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate
methyl 4-[(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate
Compound characteristics
| Compound ID: | Y202-7177 |
| Compound Name: | methyl 4-[(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate |
| Molecular Weight: | 366.48 |
| Molecular Formula: | C18 H26 N2 O4 S |
| Smiles: | CC(C)(C)C1CCc2c(C(N)=O)c(NC(CCC(=O)OC)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8549 |
| logD: | 1.3628 |
| logSw: | -2.3964 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.741 |
| InChI Key: | ZIWIIJGPQKVOHW-SNVBAGLBSA-N |