A1926/0081010
TL;DR: A1926/0081010 (CAS 18476-11-4) is a chemical compound with molecular formula C27H27N3O3 and molecular weight 441.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-phenylmethyl]amino]benzoate
Also Known As: A1926/0081010, ethyl 4-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)(phenyl)methyl]amino}benzoate, ethyl 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-phenylmethyl]amino]benzoate, ethyl 4-{[(2,3-dimethyl-5-oxo-1-phenyl(3-pyrazolin-4-yl))phenylmethyl]amino}be nzoate, ethyl 4-(((1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)(phenyl)methyl)amino)benzoate
| Molecular Formula | C27H27N3O3 |
|---|---|
| Molecular Weight | 441.21 g/mol |
| LogP | 4.86262 |
| Topological Polar Surface Area | 65.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.20523 |
| Heavy Atoms | 33 |
| Complexity | 1290.4535 |
Chemical Identifiers
| CAS Number | 18476-11-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(C2=CC=CC=C2)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C |
Product Overview
A1926/0081010 (CAS 18476-11-4), with molecular formula C27H27N3O3 and molecular weight 441.21 g/mol. IUPAC: ethyl 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-phenylmethyl]amino]benzoate.
Chemical Property Profile of A1926/0081010
Property Insights of A1926/0081010
The XLogP value of 4.86262 indicates that A1926/0081010 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.26 Ų falls within the moderate polarity range, balancing permeability and solubility for A1926/0081010. Following Lipinski's Rule of Five, A1926/0081010 has 1 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 A1926/0081010?
The CAS number of A1926/0081010 is 18476-11-4.
What is the molecular formula of A1926/0081010?
The molecular formula of A1926/0081010 is C27H27N3O3.
What is the molecular weight of A1926/0081010?
The molecular weight of A1926/0081010 is 441.21 g/mol.
Where can I buy A1926/0081010?
You can request a quote for A1926/0081010 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1926/0081010?
Yes, KEHONG BIO provides custom synthesis services for A1926/0081010 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.