{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-methyl-1,2,3-thiadiazol-5-yl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-methyl-1,2,3-thiadiazol-5-yl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-methyl-1,2,3-thiadiazol-5-yl)methanone
Compound characteristics
| Compound ID: | D319-0827 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-methyl-1,2,3-thiadiazol-5-yl)methanone |
| Molecular Weight: | 346.41 |
| Molecular Formula: | C16 H18 N4 O3 S |
| Smiles: | Cc1c(C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)snn1 |
| Stereo: | ACHIRAL |
| logP: | 1.471 |
| logD: | 1.2862 |
| logSw: | -2.4191 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.986 |
| InChI Key: | JCZXMSCUNQXKID-UHFFFAOYSA-N |