5-{benzyl[(furan-2-yl)methyl]amino}-N-(3-chloro-4-methylphenyl)-2-(ethanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-{benzyl[(furan-2-yl)methyl]amino}-N-(3-chloro-4-methylphenyl)-2-(ethanesulfonyl)pyrimidine-4-carboxamide
5-{benzyl[(furan-2-yl)methyl]amino}-N-(3-chloro-4-methylphenyl)-2-(ethanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D299-1323 |
| Compound Name: | 5-{benzyl[(furan-2-yl)methyl]amino}-N-(3-chloro-4-methylphenyl)-2-(ethanesulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 525.03 |
| Molecular Formula: | C26 H25 Cl N4 O4 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(CC)(=O)=O)N(Cc1ccccc1)Cc1ccco1)=O)c1ccc(C)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4701 |
| logD: | 5.3839 |
| logSw: | -5.8668 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.97 |
| InChI Key: | AEEFDCOWZDMNJR-UHFFFAOYSA-N |