3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide
TL;DR: 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide (CAS 7234-98-2) is a chemical compound with molecular formula C18H22BrNO2 and molecular weight 363.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide
Also Known As: 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide
| Molecular Formula | C18H22BrNO2 |
|---|---|
| Molecular Weight | 363.08 g/mol |
| LogP | 4.1479 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.0834 |
| Heavy Atoms | 22 |
| Complexity | 619.23413 |
Chemical Identifiers
| CAS Number | 7234-98-2 |
|---|---|
| SMILES | CC1=C(C(C(CC1=O)C(=O)NC(C)C2=CC=CC=C2)(C)C)Br |
Product Overview
3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide (CAS 7234-98-2), with molecular formula C18H22BrNO2 and molecular weight 363.08 g/mol. IUPAC: 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide.
Chemical Property Profile of 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide
Property Insights of 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide
The XLogP value of 4.1479 indicates that 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.17 Ų, 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide has 1 hydrogen bond donor(s) and 2 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 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide?
The CAS number of 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide is 7234-98-2.
What is the molecular formula of 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide?
The molecular formula of 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide is C18H22BrNO2.
What is the molecular weight of 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide?
The molecular weight of 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide is 363.08 g/mol.
Where can I buy 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide?
You can request a quote for 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-2,2,4-trimethyl-5-oxo-N-(1-phenylethyl)cyclohex-3-ene-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.