3-[2-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
Chemical Structure Depiction of
3-[2-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
3-[2-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
Compound characteristics
| Compound ID: | 4994-0706 |
| Compound Name: | 3-[2-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile |
| Molecular Weight: | 483.34 |
| Molecular Formula: | C21 H15 Br N4 O3 S |
| Smiles: | C(CN(C1c2ccccc2S(N=1)(=O)=O)/N=C/c1ccc(c2ccc(cc2)[Br])o1)C#N |
| Stereo: | ACHIRAL |
| logP: | 3.8326 |
| logD: | 3.8326 |
| logSw: | -4.152 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.235 |
| InChI Key: | CEEYLNIYTHSTBX-UHFFFAOYSA-N |