N-[(3-chlorophenyl)methyl]-N-(3,4-dimethoxyphenyl)-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-N-(3,4-dimethoxyphenyl)-3-nitrobenzene-1-sulfonamide
N-[(3-chlorophenyl)methyl]-N-(3,4-dimethoxyphenyl)-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V028-6576 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-N-(3,4-dimethoxyphenyl)-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 462.91 |
| Molecular Formula: | C21 H19 Cl N2 O6 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1OC)N(Cc1cccc(c1)[Cl])S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.634 |
| logD: | 4.634 |
| logSw: | -4.8747 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.435 |
| InChI Key: | KEDQGLXAMDVFKZ-UHFFFAOYSA-N |