![6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one structure](/static/products/900/900874-83-1.png)
6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one
TL;DR: 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one (CAS 900874-83-1) 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.
9-butyl-6-(4-chlorophenyl)-4-methyl-5,6,8,10,17-pentazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(17),2(7),4,8,11,13,15-heptaen-3-one
Also Known As: 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one, 6-butyl-4-(4-chlorophenyl)-2-methylpyridazino[3',4':4,5]pyrimido[1,6-a]benzimidazol-1(4H)-one
| Molecular Formula | C23H20ClN5O |
|---|---|
| Molecular Weight | 417.14 g/mol |
| LogP | 4.88602 |
| Topological Polar Surface Area | 65.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 417.13565 |
| Heavy Atoms | 30 |
| Complexity | 1467.3125 |
Chemical Identifiers
| CAS Number | 900874-83-1 |
|---|---|
| SMILES | CCCCC1=NC2=C(C(=O)C(=NN2C3=CC=C(C=C3)Cl)C)C4=NC5=CC=CC=C5N14 |
Product Overview
6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one (CAS 900874-83-1), with molecular formula C23H20ClN5O and molecular weight 417.14 g/mol. IUPAC: 9-butyl-6-(4-chlorophenyl)-4-methyl-5,6,8,10,17-pentazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(17),2(7),4,8,11,13,15-heptaen-3-one.
Chemical Property Profile of 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one
Property Insights of 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one
The XLogP value of 4.88602 indicates that 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one. Following Lipinski's Rule of Five, 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one 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 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one?
The CAS number of 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one is 900874-83-1.
What is the molecular formula of 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one?
The molecular formula of 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one is C23H20ClN5O.
What is the molecular weight of 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one?
The molecular weight of 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one is 417.14 g/mol.
Where can I buy 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one?
You can request a quote for 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-butyl-4-(4-chlorophenyl)-2-methylbenzo[4',5']imidazo[1',2':1,6]pyrimido[4,5-c]pyridazin-1(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.