2-methoxy-5-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
2-methoxy-5-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V003-3798 |
| Compound Name: | 2-methoxy-5-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 531.45 |
| Molecular Formula: | C23 H28 Cl2 N2 O6 S |
| Smiles: | CC(C)NC(N(CC1CCCO1)Cc1ccc(c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1702 |
| logD: | 4.1702 |
| logSw: | -4.4515 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.7 |
| InChI Key: | FIDHLUHSZBMVDT-QGZVFWFLSA-N |