4-{[tert-butyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[tert-butyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[tert-butyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-1559 |
| Compound Name: | 4-{[tert-butyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 448.58 |
| Molecular Formula: | C23 H32 N2 O5 S |
| Smiles: | CC(C)CN(Cc1ccc(cc1)OS(c1ccc(cc1)OC)(=O)=O)C(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9069 |
| logD: | 4.9069 |
| logSw: | -4.5115 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.993 |
| InChI Key: | DGVGTLNMLOPXMV-UHFFFAOYSA-N |