1-(2-fluorophenyl)-5-{[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(2-fluorophenyl)-5-{[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(2-fluorophenyl)-5-{[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3669-2138 |
| Compound Name: | 1-(2-fluorophenyl)-5-{[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 412.48 |
| Molecular Formula: | C22 H21 F N2 O3 S |
| Smiles: | CC(C)c1cc(\C=C2/C(NC(N(C2=O)c2ccccc2F)=S)=O)c(C)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.3053 |
| logD: | 3.8182 |
| logSw: | -4.3271 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.558 |
| InChI Key: | PEDTUDZDEJIZSU-UHFFFAOYSA-N |