1-{[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylthiophen-2-yl)methyl]amino}-3-(benzyloxy)propan-2-ol
Chemical Structure Depiction of
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylthiophen-2-yl)methyl]amino}-3-(benzyloxy)propan-2-ol
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylthiophen-2-yl)methyl]amino}-3-(benzyloxy)propan-2-ol
Compound characteristics
| Compound ID: | V017-7868 |
| Compound Name: | 1-{[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylthiophen-2-yl)methyl]amino}-3-(benzyloxy)propan-2-ol |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C24 H27 N O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN(CC(COCc2ccccc2)O)Cc2ccc3c(c2)OCO3)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6687 |
| logD: | 3.3968 |
| logSw: | -4.5527 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.866 |
| InChI Key: | YCSUUXRECHFICK-NRFANRHFSA-N |