5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3667-0461 |
| Compound Name: | 5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 372.83 |
| Molecular Formula: | C18 H13 Cl N2 O3 S |
| Smiles: | C=CCN1C(C(=C/c2ccc(c3ccc(cc3)[Cl])o2)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8939 |
| logD: | 3.821 |
| logSw: | -4.5778 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.66 |
| InChI Key: | IWWFVEPYIZYFPO-UHFFFAOYSA-N |