ethyl 2-(2-{[4-methoxy-2-methyl-5-(propan-2-yl)benzene-1-sulfonyl]oxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-{[4-methoxy-2-methyl-5-(propan-2-yl)benzene-1-sulfonyl]oxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2-{[4-methoxy-2-methyl-5-(propan-2-yl)benzene-1-sulfonyl]oxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8017-1290 |
| Compound Name: | ethyl 2-(2-{[4-methoxy-2-methyl-5-(propan-2-yl)benzene-1-sulfonyl]oxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 509.64 |
| Molecular Formula: | C24 H31 N O7 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(COS(c1cc(C(C)C)c(cc1C)OC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8028 |
| logD: | 1.9781 |
| logSw: | -4.6107 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.575 |
| InChI Key: | HPWDOYWXEDSRRC-UHFFFAOYSA-N |