N-(4,6-dimethylpyrimidin-2-yl)-4-{[3-(3-methoxyphenyl)-3-oxoprop-1-en-1-yl]amino}benzene-1-sulfonamide
Chemical Structure Depiction of
N-(4,6-dimethylpyrimidin-2-yl)-4-{[3-(3-methoxyphenyl)-3-oxoprop-1-en-1-yl]amino}benzene-1-sulfonamide
N-(4,6-dimethylpyrimidin-2-yl)-4-{[3-(3-methoxyphenyl)-3-oxoprop-1-en-1-yl]amino}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 3300-0031 |
| Compound Name: | N-(4,6-dimethylpyrimidin-2-yl)-4-{[3-(3-methoxyphenyl)-3-oxoprop-1-en-1-yl]amino}benzene-1-sulfonamide |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | Cc1cc(C)nc(NS(c2ccc(cc2)N/C=C\C(c2cccc(c2)OC)=O)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.4865 |
| logD: | 2.0043 |
| logSw: | -3.0337 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.982 |
| InChI Key: | BDEGNMPBXHCKHM-UHFFFAOYSA-N |