5-({1-[4-(dimethylamino)phenyl]-1H-pyrrol-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({1-[4-(dimethylamino)phenyl]-1H-pyrrol-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({1-[4-(dimethylamino)phenyl]-1H-pyrrol-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3657-1080 |
| Compound Name: | 5-({1-[4-(dimethylamino)phenyl]-1H-pyrrol-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C17 H16 N4 O2 S |
| Smiles: | CN(C)c1ccc(cc1)n1cccc1C=C1C(NC(NC1=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8776 |
| logD: | 2.5075 |
| logSw: | -3.5535 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.96 |
| InChI Key: | ILMKKTCYRKYJDK-UHFFFAOYSA-N |