C23H20Cl2FN5O2
TL;DR: C23H20Cl2FN5O2 (CAS 862487-51-2) is a chemical compound with molecular formula C23H20Cl2FN5O2 and molecular weight 487.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-chloro-6-fluorophenyl)methyl]-9-(4-chlorophenyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: 3-(2-chloro-6-fluorobenzyl)-9-(4-chlorophenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, 3-[(2-chloro-6-fluorophenyl)methyl]-9-(4-chlorophenyl)-1,7-dimethyl-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione, 3-[(2-chloro-6-fluorophenyl)methyl]-9-(4-chlorophenyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione, C23H20Cl2FN5O2
| Molecular Formula | C23H20Cl2FN5O2 |
|---|---|
| Molecular Weight | 487.10 g/mol |
| LogP | 4.1787 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 487.0978 |
| Heavy Atoms | 33 |
| Complexity | 1486.5433 |
Chemical Identifiers
| CAS Number | 862487-51-2 |
|---|---|
| SMILES | CC1CN(C2=NC3=C(N2C1)C(=O)N(C(=O)N3C)CC4=C(C=CC=C4Cl)F)C5=CC=C(C=C5)Cl |
Product Overview
C23H20Cl2FN5O2 (CAS 862487-51-2), with molecular formula C23H20Cl2FN5O2 and molecular weight 487.10 g/mol. IUPAC: 3-[(2-chloro-6-fluorophenyl)methyl]-9-(4-chlorophenyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.
Chemical Property Profile of C23H20Cl2FN5O2
Property Insights of C23H20Cl2FN5O2
The XLogP value of 4.1787 indicates that C23H20Cl2FN5O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for C23H20Cl2FN5O2. Following Lipinski's Rule of Five, C23H20Cl2FN5O2 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 C23H20Cl2FN5O2?
The CAS number of C23H20Cl2FN5O2 is 862487-51-2.
What is the molecular formula of C23H20Cl2FN5O2?
The molecular formula of C23H20Cl2FN5O2 is C23H20Cl2FN5O2.
What is the molecular weight of C23H20Cl2FN5O2?
The molecular weight of C23H20Cl2FN5O2 is 487.10 g/mol.
Where can I buy C23H20Cl2FN5O2?
You can request a quote for C23H20Cl2FN5O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C23H20Cl2FN5O2?
Yes, KEHONG BIO provides custom synthesis services for C23H20Cl2FN5O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.