3-{benzyl[(5-methylthiophen-2-yl)methyl]amino}-2-hydroxypropyl butanoate
Chemical Structure Depiction of
3-{benzyl[(5-methylthiophen-2-yl)methyl]amino}-2-hydroxypropyl butanoate
3-{benzyl[(5-methylthiophen-2-yl)methyl]amino}-2-hydroxypropyl butanoate
Compound characteristics
| Compound ID: | V010-7233 |
| Compound Name: | 3-{benzyl[(5-methylthiophen-2-yl)methyl]amino}-2-hydroxypropyl butanoate |
| Molecular Weight: | 361.5 |
| Molecular Formula: | C20 H27 N O3 S |
| Salt: | not_available |
| Smiles: | CCCC(=O)OCC(CN(Cc1ccccc1)Cc1ccc(C)s1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3139 |
| logD: | 3.5157 |
| logSw: | -4.1261 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.122 |
| InChI Key: | OHOYHFJNUJVCEX-SFHVURJKSA-N |