5-({N-[2-(dimethylamino)ethyl](propan-2-yl)carbamamido}methyl)-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-({N-[2-(dimethylamino)ethyl](propan-2-yl)carbamamido}methyl)-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-({N-[2-(dimethylamino)ethyl](propan-2-yl)carbamamido}methyl)-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V009-7721 |
| Compound Name: | 5-({N-[2-(dimethylamino)ethyl](propan-2-yl)carbamamido}methyl)-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 479.59 |
| Molecular Formula: | C23 H33 N3 O6 S |
| Smiles: | CC(C)NC(N(CCN(C)C)Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8475 |
| logD: | 0.1469 |
| logSw: | -3.6449 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.705 |
| InChI Key: | IJBXIQWXLVHALC-UHFFFAOYSA-N |