AE-641/11700432
TL;DR: AE-641/11700432 (CAS 303226-52-0) is a chemical compound with molecular formula C18H14N4OS and molecular weight 334.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-methyl-12-phenyl-10-thia-1,8,12,13-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,11(15),13-hexaen-16-ol
Also Known As: AE-641/11700432, 3-methyl-1-phenyl-1,4-dihydropyrazolo[4',3':5,6][1,3]thiazino[3,2-a]benzimidazol-4-ol, 3-methyl-1-phenyl-1,4-dihydrobenzo[4,5]imidazo[2,1-b]pyrazolo[4,3-e][1,3]thiazin-4-ol
| Molecular Formula | C18H14N4OS |
|---|---|
| Molecular Weight | 334.09 g/mol |
| LogP | 3.53422 |
| Topological Polar Surface Area | 55.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 334.08884 |
| Heavy Atoms | 24 |
| Complexity | 1067.5148 |
Chemical Identifiers
| CAS Number | 303226-52-0 |
|---|---|
| SMILES | CC1=NN(C2=C1C(N3C4=CC=CC=C4N=C3S2)O)C5=CC=CC=C5 |
Product Overview
AE-641/11700432 (CAS 303226-52-0), with molecular formula C18H14N4OS and molecular weight 334.09 g/mol. IUPAC: 14-methyl-12-phenyl-10-thia-1,8,12,13-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,11(15),13-hexaen-16-ol.
Chemical Property Profile of AE-641/11700432
Property Insights of AE-641/11700432
The XLogP value of 3.53422 indicates that AE-641/11700432 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.87 Ų, AE-641/11700432 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-641/11700432 has 1 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 AE-641/11700432?
The CAS number of AE-641/11700432 is 303226-52-0.
What is the molecular formula of AE-641/11700432?
The molecular formula of AE-641/11700432 is C18H14N4OS.
What is the molecular weight of AE-641/11700432?
The molecular weight of AE-641/11700432 is 334.09 g/mol.
Where can I buy AE-641/11700432?
You can request a quote for AE-641/11700432 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-641/11700432?
Yes, KEHONG BIO provides custom synthesis services for AE-641/11700432 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.