1-{[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylthiophen-2-yl)methyl]amino}-3-[(furan-2-yl)methoxy]propan-2-ol
Chemical Structure Depiction of
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylthiophen-2-yl)methyl]amino}-3-[(furan-2-yl)methoxy]propan-2-ol
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylthiophen-2-yl)methyl]amino}-3-[(furan-2-yl)methoxy]propan-2-ol
Compound characteristics
| Compound ID: | V030-0494 |
| Compound Name: | 1-{[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylthiophen-2-yl)methyl]amino}-3-[(furan-2-yl)methoxy]propan-2-ol |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C22 H25 N O5 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN(CC(COCc2ccco2)O)Cc2ccc3c(c2)OCO3)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0395 |
| logD: | 2.7677 |
| logSw: | -4.0821 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.615 |
| InChI Key: | DCKLCSBRHSJBCP-SFHVURJKSA-N |