5-({N-[2-(dimethylamino)ethyl]-3-methylbutanamido}methyl)-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-({N-[2-(dimethylamino)ethyl]-3-methylbutanamido}methyl)-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-({N-[2-(dimethylamino)ethyl]-3-methylbutanamido}methyl)-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4707 |
| Compound Name: | 5-({N-[2-(dimethylamino)ethyl]-3-methylbutanamido}methyl)-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C24 H34 N2 O6 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(N(CCN(C)C)Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2965 |
| logD: | 2.4077 |
| logSw: | -3.7123 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.06 |
| InChI Key: | OKWKLFMDCOGZIG-UHFFFAOYSA-N |