AJ-292/42034662
TL;DR: AJ-292/42034662 (CAS 516457-52-6) is a chemical compound with molecular formula C19H29N3O2S and molecular weight 363.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamothioylamino]phenyl]acetate
Also Known As: AJ-292/42034662, methyl 2-(4-(3-(2,2,6,6-tetramethylpiperidin-4-yl)thioureido)phenyl)acetate, methyl (4-{[(2,2,6,6-tetramethylpiperidin-4-yl)carbamothioyl]amino}phenyl)acetate, methyl [4-({[(2,2,6,6-tetramethyl-4-piperidinyl)amino]carbothioyl}amino)phenyl]acetate, methyl 2-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamothioylamino]phenyl]acetate
| Molecular Formula | C19H29N3O2S |
|---|---|
| Molecular Weight | 363.20 g/mol |
| LogP | 2.9977 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.19806 |
| Heavy Atoms | 25 |
| Complexity | 610.0613 |
Chemical Identifiers
| CAS Number | 516457-52-6 |
|---|---|
| SMILES | CC1(CC(CC(N1)(C)C)NC(=S)NC2=CC=C(C=C2)CC(=O)OC)C |
Product Overview
AJ-292/42034662 (CAS 516457-52-6), with molecular formula C19H29N3O2S and molecular weight 363.20 g/mol. IUPAC: methyl 2-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamothioylamino]phenyl]acetate.
Chemical Property Profile of AJ-292/42034662
Property Insights of AJ-292/42034662
The XLogP value of 2.9977 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AJ-292/42034662. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/42034662. Following Lipinski's Rule of Five, AJ-292/42034662 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 AJ-292/42034662?
The CAS number of AJ-292/42034662 is 516457-52-6.
What is the molecular formula of AJ-292/42034662?
The molecular formula of AJ-292/42034662 is C19H29N3O2S.
What is the molecular weight of AJ-292/42034662?
The molecular weight of AJ-292/42034662 is 363.20 g/mol.
Where can I buy AJ-292/42034662?
You can request a quote for AJ-292/42034662 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/42034662?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/42034662 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.