Bionet1_004318
TL;DR: Bionet1_004318 (CAS 477710-45-5) is a chemical compound with molecular formula C18H18N4O3S and molecular weight 370.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,5-dimethyl-1-[5-(thiophene-2-carbonylamino)-2-pyridinyl]pyrazole-4-carboxylate
Also Known As: Bionet1_004318, ethyl 3,5-dimethyl-1-{5-[(2-thienylcarbonyl)amino]-2-pyridinyl}-1H-pyrazole-4-carboxylate, 1R-0636, ethyl 3,5-dimethyl-1-[5-(thiophene-2-amido)pyridin-2-yl]-1H-pyrazole-4-carboxylate, ethyl 3,5-dimethyl-1-[5-(thiophene-2-carbonylamino)pyridin-2-yl]pyrazole-4-carboxylate
| Molecular Formula | C18H18N4O3S |
|---|---|
| Molecular Weight | 370.11 g/mol |
| LogP | 3.37464 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.10995 |
| Heavy Atoms | 26 |
| Complexity | 930.25934 |
Chemical Identifiers
| CAS Number | 477710-45-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1C)C2=NC=C(C=C2)NC(=O)C3=CC=CS3)C |
Product Overview
Bionet1_004318 (CAS 477710-45-5), with molecular formula C18H18N4O3S and molecular weight 370.11 g/mol. IUPAC: ethyl 3,5-dimethyl-1-[5-(thiophene-2-carbonylamino)-2-pyridinyl]pyrazole-4-carboxylate.
Chemical Property Profile of Bionet1_004318
Property Insights of Bionet1_004318
The XLogP value of 3.37464 indicates that Bionet1_004318 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004318. Following Lipinski's Rule of Five, Bionet1_004318 has 1 hydrogen bond donor(s) and 6 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 Bionet1_004318?
The CAS number of Bionet1_004318 is 477710-45-5.
What is the molecular formula of Bionet1_004318?
The molecular formula of Bionet1_004318 is C18H18N4O3S.
What is the molecular weight of Bionet1_004318?
The molecular weight of Bionet1_004318 is 370.11 g/mol.
Where can I buy Bionet1_004318?
You can request a quote for Bionet1_004318 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004318?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004318 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.