AN-988/40874860
TL;DR: AN-988/40874860 (CAS 428463-32-5) is a chemical compound with molecular formula C22H18N4O2S and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide
Also Known As: AN-988/40874860, N-(3-methylbenzoyl)-N'-(2-methyl-5-[1,3]oxazolo[4,5-b]pyridin-2-ylphenyl)thiourea, 3-methyl-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide, 3-methyl-N-{[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
| Molecular Formula | C22H18N4O2S |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 4.63344 |
| Topological Polar Surface Area | 80.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.11505 |
| Heavy Atoms | 29 |
| Complexity | 1199.4546 |
Chemical Identifiers
| CAS Number | 428463-32-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC=N4)C |
Product Overview
AN-988/40874860 (CAS 428463-32-5), with molecular formula C22H18N4O2S and molecular weight 402.12 g/mol. IUPAC: 3-methyl-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of AN-988/40874860
Property Insights of AN-988/40874860
The XLogP value of 4.63344 indicates that AN-988/40874860 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.05 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-988/40874860. Following Lipinski's Rule of Five, AN-988/40874860 has 2 hydrogen bond donor(s) and 5 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 AN-988/40874860?
The CAS number of AN-988/40874860 is 428463-32-5.
What is the molecular formula of AN-988/40874860?
The molecular formula of AN-988/40874860 is C22H18N4O2S.
What is the molecular weight of AN-988/40874860?
The molecular weight of AN-988/40874860 is 402.12 g/mol.
Where can I buy AN-988/40874860?
You can request a quote for AN-988/40874860 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-988/40874860?
Yes, KEHONG BIO provides custom synthesis services for AN-988/40874860 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.