4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidine
Chemical Structure Depiction of
4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidine
4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | G540-0479 |
| Compound Name: | 4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidine |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C25 H24 N4 O3 S |
| Smiles: | COc1ccc(cc1)c1csc2c1c(ncn2)N1CCN(CC1)Cc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 5.0664 |
| logD: | 4.462 |
| logSw: | -4.8654 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.467 |
| InChI Key: | CJJNGCVEGIJBGG-UHFFFAOYSA-N |