N-(3-chloro-4-methoxyphenyl)-5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide
N-(3-chloro-4-methoxyphenyl)-5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K895-0246 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 438.93 |
| Molecular Formula: | C22 H19 Cl N4 O2 S |
| Smiles: | Cc1c2c(ncnc2sc1C(Nc1ccc(c(c1)[Cl])OC)=O)N(C)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1023 |
| logD: | 5.0663 |
| logSw: | -5.6186 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.981 |
| InChI Key: | HJJZEERQELEHJB-UHFFFAOYSA-N |