![2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide structure](/static/products/7066/7066-48-0.webp)
2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide
TL;DR: 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide (CAS 7066-48-0) is a chemical compound with molecular formula C13H19N3OS and molecular weight 265.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-hydroxy-3,5-di(propan-2-yl)phenyl]iminothiourea
Also Known As: 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide, [(4-oxo-3,5-dipropan-2-yl-1-cyclohexa-2,5-dienylidene)amino]thiourea, [[4-oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino]thiourea
| Molecular Formula | C13H19N3OS |
|---|---|
| Molecular Weight | 265.12 g/mol |
| LogP | 3.9663 |
| Topological Polar Surface Area | 70.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.12488 |
| Heavy Atoms | 18 |
| Complexity | 452.11984 |
Chemical Identifiers
| CAS Number | 7066-48-0 |
|---|---|
| SMILES | CC(C)C1=CC(=CC(=C1O)C(C)C)N=NC(=S)N |
Product Overview
2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide (CAS 7066-48-0), with molecular formula C13H19N3OS and molecular weight 265.12 g/mol. IUPAC: [4-hydroxy-3,5-di(propan-2-yl)phenyl]iminothiourea.
Chemical Property Profile of 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide
Property Insights of 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide
The XLogP value of 3.9663 indicates that 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide. Following Lipinski's Rule of Five, 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide has 2 hydrogen bond donor(s) and 3 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 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide?
The CAS number of 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide is 7066-48-0.
What is the molecular formula of 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide?
The molecular formula of 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide is C13H19N3OS.
What is the molecular weight of 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide?
The molecular weight of 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide is 265.12 g/mol.
Where can I buy 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide?
You can request a quote for 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-Oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]hydrazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.