5-chloro-N-(2,4-dimethoxyphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(2,4-dimethoxyphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-(2,4-dimethoxyphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0104 |
| Compound Name: | 5-chloro-N-(2,4-dimethoxyphenyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 353.83 |
| Molecular Formula: | C15 H16 Cl N3 O3 S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCC)[Cl])=O)c1ccc(cc1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6813 |
| logD: | 3.6212 |
| logSw: | -3.9511 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.391 |
| InChI Key: | DOGVSIAOBJUQFD-UHFFFAOYSA-N |