F0745-0013
TL;DR: F0745-0013 (CAS 304862-12-2) is a chemical compound with molecular formula C21H23F2NO4 and molecular weight 391.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[4-(difluoromethoxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: F0745-0013, methyl 4-(4-(difluoromethoxy)phenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 4-[4-(difluoromethoxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, methyl 4-[4-(difluoromethoxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C21H23F2NO4 |
|---|---|
| Molecular Weight | 391.16 g/mol |
| LogP | 4.065 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.15952 |
| Heavy Atoms | 28 |
| Complexity | 868.8967 |
Chemical Identifiers
| CAS Number | 304862-12-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)OC(F)F)C(=O)OC |
Product Overview
F0745-0013 (CAS 304862-12-2), with molecular formula C21H23F2NO4 and molecular weight 391.16 g/mol. IUPAC: methyl 4-[4-(difluoromethoxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of F0745-0013
Property Insights of F0745-0013
The XLogP value of 4.065 indicates that F0745-0013 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for F0745-0013. Following Lipinski's Rule of Five, F0745-0013 has 1 hydrogen bond donor(s) and 5 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 F0745-0013?
The CAS number of F0745-0013 is 304862-12-2.
What is the molecular formula of F0745-0013?
The molecular formula of F0745-0013 is C21H23F2NO4.
What is the molecular weight of F0745-0013?
The molecular weight of F0745-0013 is 391.16 g/mol.
Where can I buy F0745-0013?
You can request a quote for F0745-0013 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0745-0013?
Yes, KEHONG BIO provides custom synthesis services for F0745-0013 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.