5-{[(5-bromothiophen-2-yl)methylidene]amino}-2,3-dihydrophthalazine-1,4-dione
Chemical Structure Depiction of
5-{[(5-bromothiophen-2-yl)methylidene]amino}-2,3-dihydrophthalazine-1,4-dione
5-{[(5-bromothiophen-2-yl)methylidene]amino}-2,3-dihydrophthalazine-1,4-dione
Compound characteristics
| Compound ID: | 8006-2613 |
| Compound Name: | 5-{[(5-bromothiophen-2-yl)methylidene]amino}-2,3-dihydrophthalazine-1,4-dione |
| Molecular Weight: | 350.19 |
| Molecular Formula: | C13 H8 Br N3 O2 S |
| Smiles: | C(\c1ccc(s1)[Br])=N/c1cccc2C(NNC(c12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3598 |
| logD: | 2.3566 |
| logSw: | -2.9081 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.145 |
| InChI Key: | TWVJIWQCPIAKGH-UHFFFAOYSA-N |