3-(2,3-dihydro-1-benzofuran-5-yl)-N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]propanamide
Chemical Structure Depiction of
3-(2,3-dihydro-1-benzofuran-5-yl)-N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]propanamide
3-(2,3-dihydro-1-benzofuran-5-yl)-N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]propanamide
Compound characteristics
| Compound ID: | Y042-7350 |
| Compound Name: | 3-(2,3-dihydro-1-benzofuran-5-yl)-N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]propanamide |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C23 H27 N3 O2 S |
| Smiles: | Cn1c2ccccc2nc1[C@H](CCSC)NC(CCc1ccc2c(CCO2)c1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.872 |
| logD: | 3.8681 |
| logSw: | -3.908 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.317 |
| InChI Key: | XAQDCPZSURCJEZ-IBGZPJMESA-N |