C21H17ClFNO3
TL;DR: C21H17ClFNO3 (CAS 877784-35-5) is a chemical compound with molecular formula C21H17ClFNO3 and molecular weight 385.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-chloro-6-fluorophenyl)methyl]-6,17-dioxa-4-azatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2(7),8,11(15)-tetraen-16-one
Also Known As: 3-(2-chloro-6-fluorobenzyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
| Molecular Formula | C21H17ClFNO3 |
|---|---|
| Molecular Weight | 385.09 g/mol |
| LogP | 4.4263 |
| Topological Polar Surface Area | 42.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 385.0881 |
| Heavy Atoms | 27 |
| Complexity | 1104.3403 |
Chemical Identifiers
| CAS Number | 877784-35-5 |
|---|---|
| SMILES | C1CC2=C(C1)C(=O)OC3=C2C=CC4=C3CN(CO4)CC5=C(C=CC=C5Cl)F |
Product Overview
C21H17ClFNO3 (CAS 877784-35-5), with molecular formula C21H17ClFNO3 and molecular weight 385.09 g/mol. IUPAC: 4-[(2-chloro-6-fluorophenyl)methyl]-6,17-dioxa-4-azatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2(7),8,11(15)-tetraen-16-one.
Chemical Property Profile of C21H17ClFNO3
Property Insights of C21H17ClFNO3
The XLogP value of 4.4263 indicates that C21H17ClFNO3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.68 Ų, C21H17ClFNO3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C21H17ClFNO3 has 0 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 C21H17ClFNO3?
The CAS number of C21H17ClFNO3 is 877784-35-5.
What is the molecular formula of C21H17ClFNO3?
The molecular formula of C21H17ClFNO3 is C21H17ClFNO3.
What is the molecular weight of C21H17ClFNO3?
The molecular weight of C21H17ClFNO3 is 385.09 g/mol.
Where can I buy C21H17ClFNO3?
You can request a quote for C21H17ClFNO3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C21H17ClFNO3?
Yes, KEHONG BIO provides custom synthesis services for C21H17ClFNO3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.