AP-970/42111563
TL;DR: AP-970/42111563 (CAS 637735-63-8) is a chemical compound with molecular formula C19H19BrClN3O3S and molecular weight 483.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-chloro-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide
Also Known As: AP-970/42111563, 5-bromo-2-chloro-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide, 5-bromo-2-chloro-N-({3-methoxy-4-[(2-methylpropanoyl)amino]phenyl}carbamothioyl)benzamide, 5-bromo-2-chloro-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]thiocarbamoyl]benzamide, N-[4-({[(5-bromo-2-chlorobenzoyl)amino]carbothioyl}amino)-2-methoxyphenyl]-2-methylpropanamide
| Molecular Formula | C19H19BrClN3O3S |
|---|---|
| Molecular Weight | 483.00 g/mol |
| LogP | 4.8324 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 483.0019 |
| Heavy Atoms | 28 |
| Complexity | 921.292 |
Chemical Identifiers
| CAS Number | 637735-63-8 |
|---|---|
| SMILES | CC(C)C(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)Cl)OC |
Product Overview
AP-970/42111563 (CAS 637735-63-8), with molecular formula C19H19BrClN3O3S and molecular weight 483.00 g/mol. IUPAC: 5-bromo-2-chloro-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of AP-970/42111563
Property Insights of AP-970/42111563
The XLogP value of 4.8324 indicates that AP-970/42111563 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42111563. Following Lipinski's Rule of Five, AP-970/42111563 has 3 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 AP-970/42111563?
The CAS number of AP-970/42111563 is 637735-63-8.
What is the molecular formula of AP-970/42111563?
The molecular formula of AP-970/42111563 is C19H19BrClN3O3S.
What is the molecular weight of AP-970/42111563?
The molecular weight of AP-970/42111563 is 483.00 g/mol.
Where can I buy AP-970/42111563?
You can request a quote for AP-970/42111563 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42111563?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42111563 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.