1,3,4-Thiadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-
5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-amine
Also Known As: 5-(1,3-Benzodioxol-5-yl)-1,3,4-thiadiazol-2-amine|5-(BENZO[D][1,3]DIOXOL-5-YL)-1,3,4-THIADIAZOL-2-AMINE|Oprea1_014555|Oprea1_113712|KS-00001KR0|1,3,4-Thiadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-|5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-amine|BAS 00857936|5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-ylamine|2-amino-5-(3,4-methylenedioxyphenyl)-1,3,4-thiadiazole|SR-01000394302-1|2-Amino-5-(benzo[d][1,3]dioxol-5-yl)-1,3,4-thiadiazole|1,3,4-Thiadiazol-2-amine,5-(1,3-benzodioxol-5-yl)-|5-Benzo[1,3]dioxol-5-yl-[1,3,4]thiadiazol-2-ylamine|5-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-1,3,4-thiadiazole-2-ylamine
| Molecular Formula | C9H7N3O2S |
|---|---|
| Molecular Weight | 221.0259 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 98.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.0259 |
| Monoisotopic Mass | 221.0259 |
| Heavy Atoms | 15 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 3367-89-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=NN=C(S3)N |
| InChIKey | HPGXVMFPLXUDND-UHFFFAOYSA-N |
Product Overview
1,3,4-Thiadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)- (CAS 3367-89-3), with molecular formula C9H7N3O2S and molecular weight 221.0259 g/mol. IUPAC: 5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-amine.