1,3-dimethyl-5-({4-[(4-nitrophenyl)methoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1,3-dimethyl-5-({4-[(4-nitrophenyl)methoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
1,3-dimethyl-5-({4-[(4-nitrophenyl)methoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3679-2120 |
| Compound Name: | 1,3-dimethyl-5-({4-[(4-nitrophenyl)methoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 411.43 |
| Molecular Formula: | C20 H17 N3 O5 S |
| Smiles: | CN1C(C(=Cc2ccc(cc2)OCc2ccc(cc2)[N+]([O-])=O)C(N(C)C1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5028 |
| logD: | 2.5028 |
| logSw: | -2.648 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 72.427 |
| InChI Key: | YHPQMLKDRVBEBX-UHFFFAOYSA-N |