1-(5-amino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)-2-(2,4-dibromophenoxy)ethan-1-one
Chemical Structure Depiction of
1-(5-amino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)-2-(2,4-dibromophenoxy)ethan-1-one
1-(5-amino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)-2-(2,4-dibromophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | Y203-0049 |
| Compound Name: | 1-(5-amino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)-2-(2,4-dibromophenoxy)ethan-1-one |
| Molecular Weight: | 423.12 |
| Molecular Formula: | C12 H13 Br2 N3 O2 S |
| Smiles: | CC1(C)N(C(COc2ccc(cc2[Br])[Br])=O)N=C(N)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.1484 |
| logD: | 3.1468 |
| logSw: | -3.1391 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.988 |
| InChI Key: | QKFZZGVLNLTPMK-UHFFFAOYSA-N |