5-{[4-(dimethylamino)phenyl]methylidene}-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[4-(dimethylamino)phenyl]methylidene}-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[4-(dimethylamino)phenyl]methylidene}-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 1317-0290 |
Compound Name: | 5-{[4-(dimethylamino)phenyl]methylidene}-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 331.43 |
Molecular Formula: | C17 H21 N3 O2 S |
Smiles: | CCN1C(C(=Cc2ccc(cc2)N(C)C)C(N(CC)C1=S)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.2547 |
logD: | 2.2546 |
logSw: | -2.5661 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 34.541 |
InChI Key: | WSARKVPGXLRBJI-UHFFFAOYSA-N |