5-({1-[(4-chlorophenyl)methyl]-1H-indol-3-yl}methylidene)-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({1-[(4-chlorophenyl)methyl]-1H-indol-3-yl}methylidene)-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({1-[(4-chlorophenyl)methyl]-1H-indol-3-yl}methylidene)-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3679-0026 |
| Compound Name: | 5-({1-[(4-chlorophenyl)methyl]-1H-indol-3-yl}methylidene)-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 489.95 |
| Molecular Formula: | C26 H17 Cl F N3 O2 S |
| Smiles: | C(c1ccc(cc1)[Cl])n1cc(\C=C2/C(NC(N(C2=O)c2ccccc2F)=S)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.9726 |
| logD: | 3.4907 |
| logSw: | -5.2805 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.66 |
| InChI Key: | RYJMJDQKYYVUAV-UHFFFAOYSA-N |