Bionet1_003498
TL;DR: Bionet1_003498 (CAS 478043-43-5) is a chemical compound with molecular formula C20H18N4O4 and molecular weight 378.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-cyano-6-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylamino]-2-methylpyridine-3-carboxylate
Also Known As: Bionet1_003498, 4N-349S, methyl 5-cyano-6-({[3-(4-methoxyphenyl)-5-isoxazolyl]methyl}amino)-2-methylnicotinate, methyl 5-cyano-6-({[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl}amino)-2-methylpyridine-3-carboxylate, methyl 5-cyano-6-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylamino]-2-methylpyridine-3-carboxylate
| Molecular Formula | C20H18N4O4 |
|---|---|
| Molecular Weight | 378.13 g/mol |
| LogP | 3.324 |
| Topological Polar Surface Area | 110.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.1328 |
| Heavy Atoms | 28 |
| Complexity | 1035.3495 |
Chemical Identifiers
| CAS Number | 478043-43-5 |
|---|---|
| SMILES | CC1=C(C=C(C(=N1)NCC2=CC(=NO2)C3=CC=C(C=C3)OC)C#N)C(=O)OC |
Product Overview
Bionet1_003498 (CAS 478043-43-5), with molecular formula C20H18N4O4 and molecular weight 378.13 g/mol. IUPAC: methyl 5-cyano-6-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylamino]-2-methylpyridine-3-carboxylate.
Chemical Property Profile of Bionet1_003498
Property Insights of Bionet1_003498
The XLogP value of 3.324 indicates that Bionet1_003498 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.27 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_003498. Following Lipinski's Rule of Five, Bionet1_003498 has 1 hydrogen bond donor(s) and 8 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_003498?
The CAS number of Bionet1_003498 is 478043-43-5.
What is the molecular formula of Bionet1_003498?
The molecular formula of Bionet1_003498 is C20H18N4O4.
What is the molecular weight of Bionet1_003498?
The molecular weight of Bionet1_003498 is 378.13 g/mol.
Where can I buy Bionet1_003498?
You can request a quote for Bionet1_003498 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003498?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003498 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.