AH-487/42197617
TL;DR: AH-487/42197617 (CAS 663182-72-7) is a chemical compound with molecular formula C19H18ClN3O4S and molecular weight 419.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-5-[[2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]sulfanyl]acetyl]amino]benzoate
Also Known As: AH-487/42197617, methyl 2-chloro-5-[({[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetyl)amino]benzoate, methyl 2-chloro-5-[[2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanylacetyl]amino]benzoate, methyl 2-chloro-5-(2-((3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl)thio)acetamido)benzoate, methyl 2-chloro-5-[({[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]sulfanyl}acetyl)amino]benzoate
| Molecular Formula | C19H18ClN3O4S |
|---|---|
| Molecular Weight | 419.07 g/mol |
| LogP | 3.5789 |
| Topological Polar Surface Area | 101.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 419.07065 |
| Heavy Atoms | 28 |
| Complexity | 943.5065 |
Chemical Identifiers
| CAS Number | 663182-72-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)SCC(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC)C#N)COC |
Product Overview
AH-487/42197617 (CAS 663182-72-7), with molecular formula C19H18ClN3O4S and molecular weight 419.07 g/mol. IUPAC: methyl 2-chloro-5-[[2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of AH-487/42197617
Property Insights of AH-487/42197617
The XLogP value of 3.5789 indicates that AH-487/42197617 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.31 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/42197617. Following Lipinski's Rule of Five, AH-487/42197617 has 1 hydrogen bond donor(s) and 7 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 AH-487/42197617?
The CAS number of AH-487/42197617 is 663182-72-7.
What is the molecular formula of AH-487/42197617?
The molecular formula of AH-487/42197617 is C19H18ClN3O4S.
What is the molecular weight of AH-487/42197617?
The molecular weight of AH-487/42197617 is 419.07 g/mol.
Where can I buy AH-487/42197617?
You can request a quote for AH-487/42197617 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/42197617?
Yes, KEHONG BIO provides custom synthesis services for AH-487/42197617 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.