{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{4-methyl-2-[(pyridin-2-yl)amino]-1,3-thiazol-5-yl}methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{4-methyl-2-[(pyridin-2-yl)amino]-1,3-thiazol-5-yl}methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{4-methyl-2-[(pyridin-2-yl)amino]-1,3-thiazol-5-yl}methanone
Compound characteristics
| Compound ID: | M008-1324 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{4-methyl-2-[(pyridin-2-yl)amino]-1,3-thiazol-5-yl}methanone |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C22 H23 N5 O3 S |
| Smiles: | Cc1c(C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)sc(Nc2ccccn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4946 |
| logD: | 3.3099 |
| logSw: | -3.7746 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.693 |
| InChI Key: | HROKMEIQIPGRGW-UHFFFAOYSA-N |