6-bromo-2-[2-(phenylcarbamothioyl)hydrazinylidene]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-2-[2-(phenylcarbamothioyl)hydrazinylidene]-2H-1-benzopyran-3-carboxamide
6-bromo-2-[2-(phenylcarbamothioyl)hydrazinylidene]-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 1391-0635 |
| Compound Name: | 6-bromo-2-[2-(phenylcarbamothioyl)hydrazinylidene]-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 417.28 |
| Molecular Formula: | C17 H13 Br N4 O2 S |
| Smiles: | C1=C(\C(=N/NC(Nc2ccccc2)=S)Oc2ccc(cc12)[Br])C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2136 |
| logD: | 3.2135 |
| logSw: | -3.6077 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 72.882 |
| InChI Key: | BAPJENJOKJNMLW-UHFFFAOYSA-N |