5-{[(4-tert-butylphenyl)methyl][(furan-2-yl)methyl]amino}-N-(4-fluorophenyl)-2-(methanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-{[(4-tert-butylphenyl)methyl][(furan-2-yl)methyl]amino}-N-(4-fluorophenyl)-2-(methanesulfonyl)pyrimidine-4-carboxamide
5-{[(4-tert-butylphenyl)methyl][(furan-2-yl)methyl]amino}-N-(4-fluorophenyl)-2-(methanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D299-0682 |
| Compound Name: | 5-{[(4-tert-butylphenyl)methyl][(furan-2-yl)methyl]amino}-N-(4-fluorophenyl)-2-(methanesulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 536.63 |
| Molecular Formula: | C28 H29 F N4 O4 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(C)(=O)=O)N(Cc1ccc(cc1)C(C)(C)C)Cc1ccco1)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.2528 |
| logD: | 5.1968 |
| logSw: | -4.9499 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.683 |
| InChI Key: | JZFFMNSVRPQEIX-UHFFFAOYSA-N |