4-{[3-methyl-N-(2-methylpropyl)butanamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-{[3-methyl-N-(2-methylpropyl)butanamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
4-{[3-methyl-N-(2-methylpropyl)butanamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-1685 |
| Compound Name: | 4-{[3-methyl-N-(2-methylpropyl)butanamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 460.59 |
| Molecular Formula: | C24 H32 N2 O5 S |
| Smiles: | CC(C)CC(N(CC(C)C)Cc1ccc(cc1)OS(c1ccc(cc1)NC(C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.054 |
| logD: | 4.0539 |
| logSw: | -3.9946 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.217 |
| InChI Key: | FWYPAMKONBITCS-UHFFFAOYSA-N |