1-{[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]amino}-3-(4-methoxyphenoxy)propan-2-ol
Chemical Structure Depiction of
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]amino}-3-(4-methoxyphenoxy)propan-2-ol
1-{[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]amino}-3-(4-methoxyphenoxy)propan-2-ol
Compound characteristics
| Compound ID: | V014-6382 |
| Compound Name: | 1-{[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]amino}-3-(4-methoxyphenoxy)propan-2-ol |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C23 H25 N O5 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)OCC(CN(Cc1ccc2c(c1)OCO2)Cc1cccs1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3183 |
| logD: | 3.9118 |
| logSw: | -4.263 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.475 |
| InChI Key: | XEUIQGSDCRYONS-SFHVURJKSA-N |