3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate
Chemical Structure Depiction of
3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate
3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate
Compound characteristics
| Compound ID: | V016-7694 |
| Compound Name: | 3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C23 H29 N O6 |
| Salt: | not_available |
| Smiles: | CCCC(=O)OCC(CN(Cc1cccc(c1)OC)Cc1ccc2c(c1)OCO2)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8497 |
| logD: | 1.3293 |
| logSw: | -3.9223 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.763 |
| InChI Key: | HJMOYUVBLFVWEI-IBGZPJMESA-N |