N-(3-chloro-4-methylphenyl)-2-(ethanesulfonyl)-5-{[(furan-2-yl)methyl][(5-methylfuran-2-yl)methyl]amino}pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-(ethanesulfonyl)-5-{[(furan-2-yl)methyl][(5-methylfuran-2-yl)methyl]amino}pyrimidine-4-carboxamide
N-(3-chloro-4-methylphenyl)-2-(ethanesulfonyl)-5-{[(furan-2-yl)methyl][(5-methylfuran-2-yl)methyl]amino}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D299-1172 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-(ethanesulfonyl)-5-{[(furan-2-yl)methyl][(5-methylfuran-2-yl)methyl]amino}pyrimidine-4-carboxamide |
| Molecular Weight: | 529.01 |
| Molecular Formula: | C25 H25 Cl N4 O5 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(CC)(=O)=O)N(Cc1ccco1)Cc1ccc(C)o1)=O)c1ccc(C)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.352 |
| logD: | 5.2658 |
| logSw: | -5.895 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.233 |
| InChI Key: | WBOGNURKRBVIPQ-UHFFFAOYSA-N |