4-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
4-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl methanesulfonate
4-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V012-1559 |
| Compound Name: | 4-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 313.41 |
| Molecular Formula: | C15 H23 N O4 S |
| Smiles: | CC(C)C(N(Cc1ccc(cc1)OS(C)(=O)=O)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3964 |
| logD: | 2.3964 |
| logSw: | -2.6503 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.614 |
| InChI Key: | RPIUPTDPXHAHCD-UHFFFAOYSA-N |