2-{[N-di(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[N-di(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
2-{[N-di(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-7542 |
| Compound Name: | 2-{[N-di(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C21 H28 N2 O5 S |
| Smiles: | CC(C)NC(N(Cc1ccccc1OS(c1ccc(cc1)OC)(=O)=O)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2931 |
| logD: | 4.2931 |
| logSw: | -4.2974 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.974 |
| InChI Key: | AOOCNUMBHXCFCY-UHFFFAOYSA-N |