5-chloro-2-(methylsulfanyl)-N-[2-(phenylcarbamoyl)-1-benzofuran-3-yl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(methylsulfanyl)-N-[2-(phenylcarbamoyl)-1-benzofuran-3-yl]pyrimidine-4-carboxamide
5-chloro-2-(methylsulfanyl)-N-[2-(phenylcarbamoyl)-1-benzofuran-3-yl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0238 |
| Compound Name: | 5-chloro-2-(methylsulfanyl)-N-[2-(phenylcarbamoyl)-1-benzofuran-3-yl]pyrimidine-4-carboxamide |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C21 H15 Cl N4 O3 S |
| Smiles: | [H]N(C(c1c(cnc(n1)SC)[Cl])=O)c1c2ccccc2oc1C(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3599 |
| logD: | 4.1206 |
| logSw: | -4.3849 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.136 |
| InChI Key: | KSVPHAYFSFEPMA-UHFFFAOYSA-N |