5-methyl-4-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}thieno[2,3-d]pyrimidine-6-carboxylic acid
Chemical Structure Depiction of
5-methyl-4-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}thieno[2,3-d]pyrimidine-6-carboxylic acid
5-methyl-4-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}thieno[2,3-d]pyrimidine-6-carboxylic acid
Compound characteristics
| Compound ID: | G818-0360 |
| Compound Name: | 5-methyl-4-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}thieno[2,3-d]pyrimidine-6-carboxylic acid |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C22 H26 N4 O5 S |
| Smiles: | Cc1c2c(ncnc2sc1C(O)=O)N1CCN(CC1)Cc1ccc(c(c1OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.081 |
| logD: | 3.081 |
| logSw: | -3.1156 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.552 |
| InChI Key: | XDDPSKOOFZTWBX-UHFFFAOYSA-N |