![(2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide structure](/static/products/187/187404-97-3.png)
(2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide
TL;DR: (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide (CAS 187404-97-3) is a chemical compound with molecular formula C12H10ClN3O2S and molecular weight 295.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-1-(6-chloro-2-oxochromen-3-yl)ethylideneamino]thiourea
Also Known As: J3.117.531C, {[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]amino}thiourea, 1-[1-(6-Chloro-2-oxo-2H-1-benzopyran-3-yl)ethylidene]thiosemicarbazide, (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide, (E)-2-(1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene)hydrazinecarbothioamide
| Molecular Formula | C12H10ClN3O2S |
|---|---|
| Molecular Weight | 295.02 g/mol |
| LogP | 2.0036 |
| Topological Polar Surface Area | 80.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.01822 |
| Heavy Atoms | 19 |
| Complexity | 739.3222 |
Chemical Identifiers
| CAS Number | 187404-97-3 |
|---|---|
| SMILES | C/C(=N\NC(=S)N)/C1=CC2=C(C=CC(=C2)Cl)OC1=O |
Product Overview
(2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide (CAS 187404-97-3), with molecular formula C12H10ClN3O2S and molecular weight 295.02 g/mol. IUPAC: [(E)-1-(6-chloro-2-oxochromen-3-yl)ethylideneamino]thiourea.
Chemical Property Profile of (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide
Property Insights of (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide
The XLogP value of 2.0036 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide. The TPSA of 80.62 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide. Following Lipinski's Rule of Five, (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide?
The CAS number of (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide is 187404-97-3.
What is the molecular formula of (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide?
The molecular formula of (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide is C12H10ClN3O2S.
What is the molecular weight of (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide?
The molecular weight of (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide is 295.02 g/mol.
Where can I buy (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide?
You can request a quote for (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.