N-[2-(4-bromobenzoyl)hydrazinecarbothioyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[2-(4-bromobenzoyl)hydrazinecarbothioyl]-2-oxo-2H-1-benzopyran-3-carboxamide
N-[2-(4-bromobenzoyl)hydrazinecarbothioyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8009-5458 |
| Compound Name: | N-[2-(4-bromobenzoyl)hydrazinecarbothioyl]-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 446.28 |
| Molecular Formula: | C18 H12 Br N3 O4 S |
| Smiles: | C1=C(C(NC(NNC(c2ccc(cc2)[Br])=O)=S)=O)C(=O)Oc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.0414 |
| logD: | 0.0334 |
| logSw: | -3.6553 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.267 |
| InChI Key: | VOIKNZJXJCOVTE-UHFFFAOYSA-N |