RefChem:375538
TL;DR: RefChem:375538 (CAS 347319-86-2) is a chemical compound with molecular formula C22H25F2NO3 and molecular weight 389.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 04378362, BIM-0048491.P001, propyl 4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, A2555/0108814, Propyl 4-(3,4-difluorophenyl)-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-3-quinolinecarboxylate
| Molecular Formula | C22H25F2NO3 |
|---|---|
| Molecular Weight | 389.18 g/mol |
| LogP | 4.522 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.18024 |
| Heavy Atoms | 28 |
| Complexity | 899.04297 |
Chemical Identifiers
| CAS Number | 347319-86-2 |
|---|---|
| SMILES | CCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)F)F)C(=O)CC(C2)(C)C)C |
Product Overview
RefChem:375538 (CAS 347319-86-2), with molecular formula C22H25F2NO3 and molecular weight 389.18 g/mol. IUPAC: propyl 4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of RefChem:375538
Property Insights of RefChem:375538
The XLogP value of 4.522 indicates that RefChem:375538 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, RefChem:375538 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:375538 has 1 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 RefChem:375538?
The CAS number of RefChem:375538 is 347319-86-2.
What is the molecular formula of RefChem:375538?
The molecular formula of RefChem:375538 is C22H25F2NO3.
What is the molecular weight of RefChem:375538?
The molecular weight of RefChem:375538 is 389.18 g/mol.
Where can I buy RefChem:375538?
You can request a quote for RefChem:375538 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:375538?
Yes, KEHONG BIO provides custom synthesis services for RefChem:375538 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.