![{[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea structure](/static/products/3156/315698-97-6.webp)
{[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea
TL;DR: {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea (CAS 315698-97-6) is a chemical compound with molecular formula C13H19N3O2 and molecular weight 249.15 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]iminourea
Also Known As: {[4-oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea, 2,6-diisopropylbenzo-1,4-quinone 4-semicarbazone, [4-hydroxy-3,5-di(propan-2-yl)phenyl]iminourea, 2-(3,5-diisopropyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinecarboxamide, 7,7-dimethyl-5-semicarbazidoidene-m-mentha-1(6),3-dien-2-one
| Molecular Formula | C13H19N3O2 |
|---|---|
| Molecular Weight | 249.15 g/mol |
| LogP | 3.8014 |
| Topological Polar Surface Area | 88.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.14772 |
| Heavy Atoms | 18 |
| Complexity | 450.11984 |
Chemical Identifiers
| CAS Number | 315698-97-6 |
|---|---|
| SMILES | CC(C)C1=CC(=CC(=C1O)C(C)C)N=NC(=O)N |
Product Overview
{[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea (CAS 315698-97-6), with molecular formula C13H19N3O2 and molecular weight 249.15 g/mol. IUPAC: [4-hydroxy-3,5-di(propan-2-yl)phenyl]iminourea.
Chemical Property Profile of {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea
Property Insights of {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea
The XLogP value of 3.8014 indicates that {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.04 Ų falls within the moderate polarity range, balancing permeability and solubility for {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea. Following Lipinski's Rule of Five, {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea 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 {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea?
The CAS number of {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea is 315698-97-6.
What is the molecular formula of {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea?
The molecular formula of {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea is C13H19N3O2.
What is the molecular weight of {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea?
The molecular weight of {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea is 249.15 g/mol.
Where can I buy {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea?
You can request a quote for {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea?
Yes, KEHONG BIO provides custom synthesis services for {[4-Oxo-3,5-bis(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.