[4-hydroxy-6-(5-methylfuran-2-yl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinan-5-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[4-hydroxy-6-(5-methylfuran-2-yl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinan-5-yl](thiophen-2-yl)methanone
[4-hydroxy-6-(5-methylfuran-2-yl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinan-5-yl](thiophen-2-yl)methanone
Compound characteristics
Compound ID: | 4554-4716 |
Compound Name: | [4-hydroxy-6-(5-methylfuran-2-yl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinan-5-yl](thiophen-2-yl)methanone |
Molecular Weight: | 390.4 |
Molecular Formula: | C15 H13 F3 N2 O3 S2 |
Smiles: | Cc1ccc(C2C(C(c3cccs3)=O)C(C(F)(F)F)(NC(N2)=S)O)o1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.1751 |
logD: | 3.175 |
logSw: | -3.2991 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 62.716 |
InChI Key: | WNWLFAHYKYDPSC-UHFFFAOYSA-N |