2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-3654 |
| Compound Name: | 2-methoxy-5-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 462.56 |
| Molecular Formula: | C23 H30 N2 O6 S |
| Smiles: | CC(C)C(N(Cc1ccc(c(c1)OS(c1ccc(cc1)NC(C)=O)(=O)=O)OC)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9721 |
| logD: | 2.972 |
| logSw: | -3.5105 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.205 |
| InChI Key: | YYUNDBKPBDVAGU-UHFFFAOYSA-N |