3-{[N-(butan-2-yl)-3-phenylpropanamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
3-{[N-(butan-2-yl)-3-phenylpropanamido]methyl}phenyl methanesulfonate
3-{[N-(butan-2-yl)-3-phenylpropanamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V012-1570 |
| Compound Name: | 3-{[N-(butan-2-yl)-3-phenylpropanamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 389.51 |
| Molecular Formula: | C21 H27 N O4 S |
| Smiles: | CCC(C)N(Cc1cccc(c1)OS(C)(=O)=O)C(CCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9925 |
| logD: | 3.9925 |
| logSw: | -4.116 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.399 |
| InChI Key: | IQZBTTRJTFZUJK-KRWDZBQOSA-N |