1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methanesulfonyl]-1H-tetrazole
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methanesulfonyl]-1H-tetrazole
1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methanesulfonyl]-1H-tetrazole
Compound characteristics
| Compound ID: | 8018-9578 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methanesulfonyl]-1H-tetrazole |
| Molecular Weight: | 436.83 |
| Molecular Formula: | C17 H13 Cl N4 O6 S |
| Smiles: | C(c1ccc2c(c1)OCO2)n1c(nnn1)S(Cc1cc2c(cc1[Cl])OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6124 |
| logD: | 2.6124 |
| logSw: | -3.1768 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 103.391 |
| InChI Key: | XYXKAHINKNSXFU-UHFFFAOYSA-N |