1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonyl]piperazine
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonyl]piperazine
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonyl]piperazine
Compound characteristics
| Compound ID: | G008-3492 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)benzene-1-sulfonyl]piperazine |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C23 H25 N3 O6 S |
| Smiles: | Cc1cc(c2ccc(c(c2)S(N2CCN(CC2)Cc2ccc3c(c2)OCO3)(=O)=O)OC)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.963 |
| logD: | 2.8678 |
| logSw: | -3.1677 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.577 |
| InChI Key: | JYTTVCCJMYCDRT-UHFFFAOYSA-N |