ethyl 4-({[(2,4-dichlorophenyl)methyl](2,3-dihydro-1,4-benzodioxine-6-sulfonyl)amino}methyl)benzoate
Chemical Structure Depiction of
ethyl 4-({[(2,4-dichlorophenyl)methyl](2,3-dihydro-1,4-benzodioxine-6-sulfonyl)amino}methyl)benzoate
ethyl 4-({[(2,4-dichlorophenyl)methyl](2,3-dihydro-1,4-benzodioxine-6-sulfonyl)amino}methyl)benzoate
Compound characteristics
| Compound ID: | K783-3370 |
| Compound Name: | ethyl 4-({[(2,4-dichlorophenyl)methyl](2,3-dihydro-1,4-benzodioxine-6-sulfonyl)amino}methyl)benzoate |
| Molecular Weight: | 536.43 |
| Molecular Formula: | C25 H23 Cl2 N O6 S |
| Smiles: | CCOC(c1ccc(CN(Cc2ccc(cc2[Cl])[Cl])S(c2ccc3c(c2)OCCO3)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.618 |
| logD: | 5.618 |
| logSw: | -5.9442 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.919 |
| InChI Key: | FIXVWRPRXHOGMS-UHFFFAOYSA-N |