N-(3-chloro-4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
N-(3-chloro-4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K913-0018 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 512 |
| Molecular Formula: | C25 H23 Cl F N5 O2 S |
| Smiles: | Cc1c2c(ncnc2sc1C(Nc1ccc(c(c1)[Cl])F)=O)N1CCN(CC1)c1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.9388 |
| logD: | 5.3889 |
| logSw: | -6.0756 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.22 |
| InChI Key: | RPHVCJSTSVYQSV-UHFFFAOYSA-N |