2-(8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b']dipyran-9(10H)-ylidene)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-(8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b']dipyran-9(10H)-ylidene)hydrazine-1-carbothioamide
2-(8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b']dipyran-9(10H)-ylidene)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | N005-0008 |
| Compound Name: | 2-(8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b']dipyran-9(10H)-ylidene)hydrazine-1-carbothioamide |
| Molecular Weight: | 317.36 |
| Molecular Formula: | C15 H15 N3 O3 S |
| Smiles: | CC1(C)C(\Cc2c(ccc3C=CC(=O)Oc23)O1)=N/NC(N)=S |
| Stereo: | ACHIRAL |
| logP: | 2.3798 |
| logD: | 2.3798 |
| logSw: | -2.8885 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.388 |
| InChI Key: | JLNVHQKBLYOULF-UHFFFAOYSA-N |