5-({5-[(1H-benzimidazol-2-yl)sulfanyl]furan-2-yl}methylidene)-1-(4-bromophenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-({5-[(1H-benzimidazol-2-yl)sulfanyl]furan-2-yl}methylidene)-1-(4-bromophenyl)-1,3-diazinane-2,4,6-trione
5-({5-[(1H-benzimidazol-2-yl)sulfanyl]furan-2-yl}methylidene)-1-(4-bromophenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3970-2146 |
| Compound Name: | 5-({5-[(1H-benzimidazol-2-yl)sulfanyl]furan-2-yl}methylidene)-1-(4-bromophenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 509.34 |
| Molecular Formula: | C22 H13 Br N4 O4 S |
| Smiles: | C(=C1/C(NC(N(C1=O)c1ccc(cc1)[Br])=O)=O)\c1ccc(o1)Sc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.3258 |
| logD: | 4.0131 |
| logSw: | -4.5409 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.194 |
| InChI Key: | YYGSBDZHQQJGNI-UHFFFAOYSA-N |