AQ-156/41149317
TL;DR: AQ-156/41149317 (CAS 488109-47-3) is a chemical compound with molecular formula C19H16ClN3OS and molecular weight 369.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-3-methyl-1-phenyl-4,8-dihydropyrazolo[5,4-e][1,4]thiazepin-7-one
Also Known As: AQ-156/41149317, 4-(4-chlorophenyl)-3-methyl-1-phenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 4-(4-chlorophenyl)-3-methyl-1-phenyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one, 4-(4-chlorophenyl)-3-methyl-1-phenyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol, 4-(4-chlorophenyl)-3-methyl-1-phenyl-6,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(4H)-one
| Molecular Formula | C19H16ClN3OS |
|---|---|
| Molecular Weight | 369.07 g/mol |
| LogP | 4.60882 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.07025 |
| Heavy Atoms | 25 |
| Complexity | 921.84717 |
Chemical Identifiers
| CAS Number | 488109-47-3 |
|---|---|
| SMILES | CC1=NN(C2=C1C(SCC(=O)N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4 |
Product Overview
AQ-156/41149317 (CAS 488109-47-3), with molecular formula C19H16ClN3OS and molecular weight 369.07 g/mol. IUPAC: 4-(4-chlorophenyl)-3-methyl-1-phenyl-4,8-dihydropyrazolo[5,4-e][1,4]thiazepin-7-one.
Chemical Property Profile of AQ-156/41149317
Property Insights of AQ-156/41149317
The XLogP value of 4.60882 indicates that AQ-156/41149317 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, AQ-156/41149317 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AQ-156/41149317 has 1 hydrogen bond donor(s) and 3 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 AQ-156/41149317?
The CAS number of AQ-156/41149317 is 488109-47-3.
What is the molecular formula of AQ-156/41149317?
The molecular formula of AQ-156/41149317 is C19H16ClN3OS.
What is the molecular weight of AQ-156/41149317?
The molecular weight of AQ-156/41149317 is 369.07 g/mol.
Where can I buy AQ-156/41149317?
You can request a quote for AQ-156/41149317 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-156/41149317?
Yes, KEHONG BIO provides custom synthesis services for AQ-156/41149317 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.