N-{(4-butylanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{(4-butylanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methylbenzene-1-sulfonamide
N-{(4-butylanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 3966-3246 |
| Compound Name: | N-{(4-butylanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 451.59 |
| Molecular Formula: | C24 H29 N5 O2 S |
| Smiles: | CCCCc1ccc(cc1)N\C(Nc1nc(C)cc(C)n1)=N/S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9569 |
| logD: | 5.9567 |
| logSw: | -5.4186 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.149 |
| InChI Key: | VSFBQQVKGPXBJP-UHFFFAOYSA-N |