CTK8H9982
TL;DR: CTK8H9982 (CAS 28322-37-4) is a chemical compound with molecular formula C15H22ClN5O2 and molecular weight 339.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-ethylpyrrolidin-2-yl)methyl]-6-methoxy-2H-benzotriazole-5-carboxamide;hydrochloride
Also Known As: EINECS 248-965-9, N-((1-Ethylpyrrolidin-2-yl)methyl)-6-methoxy-1H-benzotriazole-5-carboxamide monohydrochloride, N-[(1-Ethylpyrrolidin-2-yl)methyl]-5-methoxy-1H-1,2,3-benzotriazole-6-carboximidic acid--hydrogen chloride (1/1), N-[(1-Ethylpyrrolidin-2-yl)methyl]-5-methoxy-1H-benzotriazole-6-carboximidic acid--hydrogen chloride (1/1)
| Molecular Formula | C15H22ClN5O2 |
|---|---|
| Molecular Weight | 339.15 g/mol |
| LogP | 1.6024 |
| Topological Polar Surface Area | 83.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.1462 |
| Heavy Atoms | 23 |
| Complexity | 674.931 |
Chemical Identifiers
| CAS Number | 28322-37-4 |
|---|---|
| SMILES | CCN1CCCC1CNC(=O)C2=CC3=NNN=C3C=C2OC.Cl |
Product Overview
CTK8H9982 (CAS 28322-37-4), with molecular formula C15H22ClN5O2 and molecular weight 339.15 g/mol. IUPAC: N-[(1-ethylpyrrolidin-2-yl)methyl]-6-methoxy-2H-benzotriazole-5-carboxamide;hydrochloride.
Chemical Property Profile of CTK8H9982
Property Insights of CTK8H9982
The XLogP value of 1.6024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK8H9982. The TPSA of 83.14 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK8H9982. Following Lipinski's Rule of Five, CTK8H9982 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 CTK8H9982?
The CAS number of CTK8H9982 is 28322-37-4.
What is the molecular formula of CTK8H9982?
The molecular formula of CTK8H9982 is C15H22ClN5O2.
What is the molecular weight of CTK8H9982?
The molecular weight of CTK8H9982 is 339.15 g/mol.
Where can I buy CTK8H9982?
You can request a quote for CTK8H9982 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8H9982?
Yes, KEHONG BIO provides custom synthesis services for CTK8H9982 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.