methyl 4-({[(3,4-dimethoxyphenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({[(3,4-dimethoxyphenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
methyl 4-({[(3,4-dimethoxyphenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate
Compound characteristics
| Compound ID: | K783-3682 |
| Compound Name: | methyl 4-({[(3,4-dimethoxyphenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}methyl)benzoate |
| Molecular Weight: | 500.53 |
| Molecular Formula: | C24 H24 N2 O8 S |
| Smiles: | COC(c1ccc(CN(Cc2ccc(c(c2)OC)OC)S(c2ccc(cc2)[N+]([O-])=O)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1968 |
| logD: | 4.1968 |
| logSw: | -4.4603 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 101.159 |
| InChI Key: | QISVRFNVPHGHHH-UHFFFAOYSA-N |