C23H20ClN5O
TL;DR: C23H20ClN5O (CAS 848727-24-2) is a chemical compound with molecular formula C23H20ClN5O and molecular weight 417.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(2-chlorophenyl)-13-(3-methylbutyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one
Also Known As: 11-(2-chlorophenyl)-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one, 11-(2-chlorophenyl)-3-isopentyl-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one
| Molecular Formula | C23H20ClN5O |
|---|---|
| Molecular Weight | 417.14 g/mol |
| LogP | 4.9831 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 417.13565 |
| Heavy Atoms | 30 |
| Complexity | 1467.7916 |
Chemical Identifiers
| CAS Number | 848727-24-2 |
|---|---|
| SMILES | CC(C)CCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=CC=C5Cl |
Product Overview
C23H20ClN5O (CAS 848727-24-2), with molecular formula C23H20ClN5O and molecular weight 417.14 g/mol. IUPAC: 17-(2-chlorophenyl)-13-(3-methylbutyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one.
Chemical Property Profile of C23H20ClN5O
Property Insights of C23H20ClN5O
The XLogP value of 4.9831 indicates that C23H20ClN5O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for C23H20ClN5O. Following Lipinski's Rule of Five, C23H20ClN5O 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 C23H20ClN5O?
The CAS number of C23H20ClN5O is 848727-24-2.
What is the molecular formula of C23H20ClN5O?
The molecular formula of C23H20ClN5O is C23H20ClN5O.
What is the molecular weight of C23H20ClN5O?
The molecular weight of C23H20ClN5O is 417.14 g/mol.
Where can I buy C23H20ClN5O?
You can request a quote for C23H20ClN5O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C23H20ClN5O?
Yes, KEHONG BIO provides custom synthesis services for C23H20ClN5O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.