CTK3E9415
TL;DR: CTK3E9415 (CAS 86871-71-8) is a chemical compound with molecular formula C19H25N3O5 and molecular weight 375.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;N,N-dimethyl-3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propan-1-amine
Also Known As: 3-(3-(Dimethylamino)propoxy)-4-methyl-5-phenylpyrazole maleate, 1-Propanamine, N,N-dimethyl-3-((4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy)-, (Z)-2-butenedioate (1:1)
| Molecular Formula | C19H25N3O5 |
|---|---|
| Molecular Weight | 375.18 g/mol |
| LogP | 2.42742 |
| Topological Polar Surface Area | 115.75 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 375.1794 |
| Heavy Atoms | 27 |
| Complexity | 737.9606 |
Chemical Identifiers
| CAS Number | 86871-71-8 |
|---|---|
| SMILES | CC1=C(NN=C1OCCCN(C)C)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O |
Product Overview
CTK3E9415 (CAS 86871-71-8), with molecular formula C19H25N3O5 and molecular weight 375.18 g/mol. IUPAC: but-2-enedioic acid;N,N-dimethyl-3-[(4-methyl-5-phenyl-1H-pyrazol-3-yl)oxy]propan-1-amine.
Chemical Property Profile of CTK3E9415
Property Insights of CTK3E9415
The XLogP value of 2.42742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK3E9415. The TPSA of 115.75 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK3E9415. Following Lipinski's Rule of Five, CTK3E9415 has 3 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 CTK3E9415?
The CAS number of CTK3E9415 is 86871-71-8.
What is the molecular formula of CTK3E9415?
The molecular formula of CTK3E9415 is C19H25N3O5.
What is the molecular weight of CTK3E9415?
The molecular weight of CTK3E9415 is 375.18 g/mol.
Where can I buy CTK3E9415?
You can request a quote for CTK3E9415 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK3E9415?
Yes, KEHONG BIO provides custom synthesis services for CTK3E9415 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.