5-{[tert-butyl-N-(propan-2-yl)carbamamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-{[tert-butyl-N-(propan-2-yl)carbamamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-{[tert-butyl-N-(propan-2-yl)carbamamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4581 |
| Compound Name: | 5-{[tert-butyl-N-(propan-2-yl)carbamamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 464.58 |
| Molecular Formula: | C23 H32 N2 O6 S |
| Smiles: | CC(C)N(Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)C(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1569 |
| logD: | 4.1569 |
| logSw: | -4.3053 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.454 |
| InChI Key: | YIXGFOYMSBZVHW-UHFFFAOYSA-N |