1-(2H-1,3-benzodioxol-5-yl)-5-[(cyclopropylmethyl)sulfanyl]-1H-tetrazole
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-5-[(cyclopropylmethyl)sulfanyl]-1H-tetrazole
1-(2H-1,3-benzodioxol-5-yl)-5-[(cyclopropylmethyl)sulfanyl]-1H-tetrazole
Compound characteristics
| Compound ID: | 8011-6975 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-5-[(cyclopropylmethyl)sulfanyl]-1H-tetrazole |
| Molecular Weight: | 276.31 |
| Molecular Formula: | C12 H12 N4 O2 S |
| Smiles: | C1CC1CSc1nnnn1c1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.7481 |
| logD: | 2.7481 |
| logSw: | -3.028 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.528 |
| InChI Key: | CCORFMLPTVXOEI-UHFFFAOYSA-N |