5-{bis[(furan-2-yl)methyl]amino}-N-(2,6-dimethylphenyl)-2-(ethanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-{bis[(furan-2-yl)methyl]amino}-N-(2,6-dimethylphenyl)-2-(ethanesulfonyl)pyrimidine-4-carboxamide
5-{bis[(furan-2-yl)methyl]amino}-N-(2,6-dimethylphenyl)-2-(ethanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D299-1138 |
| Compound Name: | 5-{bis[(furan-2-yl)methyl]amino}-N-(2,6-dimethylphenyl)-2-(ethanesulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C25 H26 N4 O5 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(CC)(=O)=O)N(Cc1ccco1)Cc1ccco1)=O)c1c(C)cccc1C |
| Stereo: | ACHIRAL |
| logP: | 3.6576 |
| logD: | 3.6548 |
| logSw: | -3.6576 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.324 |
| InChI Key: | ZGKJRSZVRNOVCK-UHFFFAOYSA-N |