1-(2-fluorophenyl)-5-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(2-fluorophenyl)-5-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(2-fluorophenyl)-5-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 8010-0885 |
Compound Name: | 1-(2-fluorophenyl)-5-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 409.41 |
Molecular Formula: | C21 H13 F2 N3 O2 S |
Smiles: | C(=C1/C(NC(N(C1=O)c1ccccc1F)=S)=O)/c1cccn1c1ccccc1F |
Stereo: | ACHIRAL |
logP: | 3.6301 |
logD: | 2.6401 |
logSw: | -4.1394 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.156 |
InChI Key: | NYTBUFPHBYHEEE-UHFFFAOYSA-N |