6-(2-amino-4-bromophenyl)-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
6-(2-amino-4-bromophenyl)-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
6-(2-amino-4-bromophenyl)-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | Y203-0046 |
| Compound Name: | 6-(2-amino-4-bromophenyl)-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 299.15 |
| Molecular Formula: | C9 H7 Br N4 O S |
| Smiles: | c1cc(C2C(NC(NN=2)=S)=O)c(cc1[Br])N |
| Stereo: | ACHIRAL |
| logP: | 2.3554 |
| logD: | 2.2431 |
| logSw: | -3.2007 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 67.714 |
| InChI Key: | ZHXNCHPEIDQKOZ-UHFFFAOYSA-N |