5-{[4-(diethylamino)phenyl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[4-(diethylamino)phenyl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[4-(diethylamino)phenyl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 4058-0076 |
Compound Name: | 5-{[4-(diethylamino)phenyl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 409.51 |
Molecular Formula: | C22 H23 N3 O3 S |
Smiles: | CCN(CC)c1ccc(/C=C2/C(NC(N(C2=O)c2ccc(cc2)OC)=S)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.6099 |
logD: | 3.2349 |
logSw: | -3.8791 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.508 |
InChI Key: | ZWQLYHMPEUMPOB-UHFFFAOYSA-N |