5-{[4-(diethylamino)-2-methoxyphenyl]methylidene}-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[4-(diethylamino)-2-methoxyphenyl]methylidene}-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[4-(diethylamino)-2-methoxyphenyl]methylidene}-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3269-0144 |
| Compound Name: | 5-{[4-(diethylamino)-2-methoxyphenyl]methylidene}-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C22 H22 F N3 O3 S |
| Smiles: | CCN(CC)c1ccc(\C=C2/C(NC(N(C2=O)c2ccc(cc2)F)=S)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7274 |
| logD: | 3.4998 |
| logSw: | -4.0862 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.595 |
| InChI Key: | HRNALRBSTOSKMV-UHFFFAOYSA-N |