N-(2,4-dimethylphenyl)-5-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-(methanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-5-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-(methanesulfonyl)pyrimidine-4-carboxamide
N-(2,4-dimethylphenyl)-5-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-(methanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D299-0365 |
| Compound Name: | N-(2,4-dimethylphenyl)-5-{[(4-fluorophenyl)methyl][(furan-2-yl)methyl]amino}-2-(methanesulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 508.57 |
| Molecular Formula: | C26 H25 F N4 O4 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(C)(=O)=O)N(Cc1ccc(cc1)F)Cc1ccco1)=O)c1ccc(C)cc1C |
| Stereo: | ACHIRAL |
| logP: | 4.1392 |
| logD: | 4.137 |
| logSw: | -4.0811 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.985 |
| InChI Key: | MBNGJSPLKHSGIP-UHFFFAOYSA-N |