ethyl 2-{2-[(1-{2-[3-(trifluoromethyl)benzamido]ethyl}-1H-indol-3-yl)sulfanyl]propanamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(1-{2-[3-(trifluoromethyl)benzamido]ethyl}-1H-indol-3-yl)sulfanyl]propanamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-{2-[(1-{2-[3-(trifluoromethyl)benzamido]ethyl}-1H-indol-3-yl)sulfanyl]propanamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | C064-0275 |
| Compound Name: | ethyl 2-{2-[(1-{2-[3-(trifluoromethyl)benzamido]ethyl}-1H-indol-3-yl)sulfanyl]propanamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 629.72 |
| Molecular Formula: | C31 H30 F3 N3 O4 S2 |
| Smiles: | CCOC(c1c2CCCc2sc1NC(C(C)Sc1cn(CCNC(c2cccc(c2)C(F)(F)F)=O)c2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2322 |
| logD: | 3.7788 |
| logSw: | -5.7209 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.401 |
| InChI Key: | XPAIBFWEZXZREU-SFHVURJKSA-N |