methyl 4-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate
methyl 4-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate
Compound characteristics
| Compound ID: | 2425-3549 |
| Compound Name: | methyl 4-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate |
| Molecular Weight: | 310.37 |
| Molecular Formula: | C14 H18 N2 O4 S |
| Smiles: | COC(CCC(Nc1c(C(N)=O)c2CCCCc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2976 |
| logD: | -0.1945 |
| logSw: | -1.3882 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.741 |
| InChI Key: | YDSSOOIPPDUIDZ-UHFFFAOYSA-N |