6-[4-(diethylamino)phenyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Chemical Structure Depiction of
6-[4-(diethylamino)phenyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
6-[4-(diethylamino)phenyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8016-2220 |
| Compound Name: | 6-[4-(diethylamino)phenyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carbonitrile |
| Molecular Weight: | 300.38 |
| Molecular Formula: | C15 H16 N4 O S |
| Smiles: | CCN(CC)c1ccc(cc1)C1=C(C#N)C(NC(N1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5467 |
| logD: | -1.8715 |
| logSw: | -2.867 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.778 |
| InChI Key: | VVJKDTKKOFHEOW-UHFFFAOYSA-N |