N-(4-chlorophenyl)-2-(ethanesulfonyl)-5-{[(furan-2-yl)methyl][(thiophen-2-yl)methyl]amino}pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-(ethanesulfonyl)-5-{[(furan-2-yl)methyl][(thiophen-2-yl)methyl]amino}pyrimidine-4-carboxamide
N-(4-chlorophenyl)-2-(ethanesulfonyl)-5-{[(furan-2-yl)methyl][(thiophen-2-yl)methyl]amino}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D299-1192 |
| Compound Name: | N-(4-chlorophenyl)-2-(ethanesulfonyl)-5-{[(furan-2-yl)methyl][(thiophen-2-yl)methyl]amino}pyrimidine-4-carboxamide |
| Molecular Weight: | 517.02 |
| Molecular Formula: | C23 H21 Cl N4 O4 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)S(CC)(=O)=O)N(Cc1ccco1)Cc1cccs1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6297 |
| logD: | 4.5737 |
| logSw: | -4.6836 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.989 |
| InChI Key: | VLMQZQMQPCATDY-UHFFFAOYSA-N |