3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone
TL;DR: 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone (CAS 333325-98-7) is a chemical compound with molecular formula C16H14ClNO2 and molecular weight 287.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chloroanilino)-5-(furan-2-yl)cyclohex-2-en-1-one
Also Known As: BAS 02232298, 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone, 3-(3-chloroanilino)-5-(furan-2-yl)cyclohex-2-en-1-one, 3-((3-chlorophenyl)amino)-5-(furan-2-yl)cyclohex-2-enone, 3-[(3-chlorophenyl)amino]-5-(furan-2-yl)cyclohex-2-en-1-one
| Molecular Formula | C16H14ClNO2 |
|---|---|
| Molecular Weight | 287.07 g/mol |
| LogP | 4.3755 |
| Topological Polar Surface Area | 42.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.07132 |
| Heavy Atoms | 20 |
| Complexity | 646.2563 |
Chemical Identifiers
| CAS Number | 333325-98-7 |
|---|---|
| SMILES | C1C(CC(=O)C=C1NC2=CC(=CC=C2)Cl)C3=CC=CO3 |
Product Overview
3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone (CAS 333325-98-7), with molecular formula C16H14ClNO2 and molecular weight 287.07 g/mol. IUPAC: 3-(3-chloroanilino)-5-(furan-2-yl)cyclohex-2-en-1-one.
Chemical Property Profile of 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone
Property Insights of 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone
The XLogP value of 4.3755 indicates that 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.24 Ų, 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone has 1 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 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone?
The CAS number of 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone is 333325-98-7.
What is the molecular formula of 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone?
The molecular formula of 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone is C16H14ClNO2.
What is the molecular weight of 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone?
The molecular weight of 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone is 287.07 g/mol.
Where can I buy 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone?
You can request a quote for 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.