![7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] structure](/static/products/863/863669-39-0.png)
7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine]
TL;DR: 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] (CAS 863669-39-0) is a chemical compound with molecular formula C20H20ClN5 and molecular weight 365.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-chloro-4-methyl-6-phenylspiro[1,5,6,8,13-pentazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-2,1'-cyclohexane]
Also Known As: 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine], 7'-Chloro-3'-methyl-1'-phenylspiro[cyclohexane-1,4'(1'H)-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine], 7a(2)-Chloro-3a(2)-methyl-1a(2)-phenylspiro[cyclohexane-1,4a(2)(1a(2)H)-pyrazolo[3a(2),4a(2):4,5]pyrimido[1,2-b]pyridazine]
| Molecular Formula | C20H20ClN5 |
|---|---|
| Molecular Weight | 365.14 g/mol |
| LogP | 4.80782 |
| Topological Polar Surface Area | 45.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 365.14072 |
| Heavy Atoms | 26 |
| Complexity | 948.0812 |
Chemical Identifiers
| CAS Number | 863669-39-0 |
|---|---|
| SMILES | CC1=NN(C2=C1C3(CCCCC3)N4C(=N2)C=CC(=N4)Cl)C5=CC=CC=C5 |
Product Overview
7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] (CAS 863669-39-0), with molecular formula C20H20ClN5 and molecular weight 365.14 g/mol. IUPAC: 12-chloro-4-methyl-6-phenylspiro[1,5,6,8,13-pentazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-2,1'-cyclohexane].
Chemical Property Profile of 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine]
Property Insights of 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine]
The XLogP value of 4.80782 indicates that 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.78 Ų, 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] 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 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine]?
The CAS number of 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] is 863669-39-0.
What is the molecular formula of 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine]?
The molecular formula of 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] is C20H20ClN5.
What is the molecular weight of 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine]?
The molecular weight of 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] is 365.14 g/mol.
Where can I buy 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine]?
You can request a quote for 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine]?
Yes, KEHONG BIO provides custom synthesis services for 7'-Chloro-3'-methyl-1'-phenyl-1'H-spiro[cyclohexane-1,4'-pyrazolo[3',4':4,5]pyrimido[1,2-b]pyridazine] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.