1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonyl]piperazine
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonyl]piperazine
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonyl]piperazine
Compound characteristics
| Compound ID: | F318-0944 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonyl]piperazine |
| Molecular Weight: | 488.58 |
| Molecular Formula: | C22 H24 N4 O5 S2 |
| Smiles: | Cc1c(cc(c2nc(C3CC3)on2)s1)S(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1169 |
| logD: | 4.0217 |
| logSw: | -4.2001 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.553 |
| InChI Key: | DGBBOUJQWJXTFY-UHFFFAOYSA-N |