N-[(4-ethylphenyl)methyl]-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
N-[(4-ethylphenyl)methyl]-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G394-0177 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C22 H27 N5 O S |
| Smiles: | CCc1ccc(CNC(c2c(C)c3c(ncnc3s2)N2CCN(C)CC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1186 |
| logD: | 3.6541 |
| logSw: | -4.1852 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.428 |
| InChI Key: | KIBVOZFXUQALLC-UHFFFAOYSA-N |