2-[1-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)ethylidene]hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-[1-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)ethylidene]hydrazine-1-carbothioamide
2-[1-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)ethylidene]hydrazine-1-carbothioamide
Compound characteristics
Compound ID: | 0833-0568 |
Compound Name: | 2-[1-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)ethylidene]hydrazine-1-carbothioamide |
Molecular Weight: | 311.36 |
Molecular Formula: | C16 H13 N3 O2 S |
Smiles: | C/C(C1=Cc2c(ccc3ccccc23)OC1=O)=N/NC(N)=S |
Stereo: | ACHIRAL |
logP: | 2.9168 |
logD: | 2.9167 |
logSw: | -3.6478 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 61.985 |
InChI Key: | RVSBXXRKYHTGAZ-UHFFFAOYSA-N |