5-chloro-2-(ethylsulfanyl)-N-{2-[(3-methylphenyl)carbamoyl]-1-benzofuran-3-yl}pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(ethylsulfanyl)-N-{2-[(3-methylphenyl)carbamoyl]-1-benzofuran-3-yl}pyrimidine-4-carboxamide
5-chloro-2-(ethylsulfanyl)-N-{2-[(3-methylphenyl)carbamoyl]-1-benzofuran-3-yl}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0349 |
| Compound Name: | 5-chloro-2-(ethylsulfanyl)-N-{2-[(3-methylphenyl)carbamoyl]-1-benzofuran-3-yl}pyrimidine-4-carboxamide |
| Molecular Weight: | 466.94 |
| Molecular Formula: | C23 H19 Cl N4 O3 S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCC)[Cl])=O)c1c2ccccc2oc1C(Nc1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3101 |
| logD: | 5.0708 |
| logSw: | -5.9382 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.136 |
| InChI Key: | XURZVWJPWMDSJY-UHFFFAOYSA-N |