propan-2-yl 2-[2-phenyl(phenylsulfanyl)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-[2-phenyl(phenylsulfanyl)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
propan-2-yl 2-[2-phenyl(phenylsulfanyl)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3365-1650 |
| Compound Name: | propan-2-yl 2-[2-phenyl(phenylsulfanyl)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 479.66 |
| Molecular Formula: | C27 H29 N O3 S2 |
| Smiles: | CC(C)OC(c1c2CCCCCc2sc1NC(C(c1ccccc1)Sc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.4161 |
| logD: | 4.3614 |
| logSw: | -5.6992 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.537 |
| InChI Key: | JVDUFHORDYRKTD-XMMPIXPASA-N |