BAS 09534400
TL;DR: BAS 09534400 (CAS 701226-86-0) is a chemical compound with molecular formula C16H16N4O3S and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Also Known As: BAS 09534400, N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide, N-[5-(ethoxymethyl)(1,3,4-thiadiazol-2-yl)](5-methyl-3-phenylisoxazol-4-yl)car boxamide, 5-Methyl-3-phenyl-isoxazole-4-carboxylic acid (5-ethoxymethyl-[1,3,4]thiadiazol-2-yl)-amide
| Molecular Formula | C16H16N4O3S |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 3.29032 |
| Topological Polar Surface Area | 90.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.0943 |
| Heavy Atoms | 24 |
| Complexity | 828.9774 |
Chemical Identifiers
| CAS Number | 701226-86-0 |
|---|---|
| SMILES | CCOCC1=NN=C(S1)NC(=O)C2=C(ON=C2C3=CC=CC=C3)C |
Product Overview
BAS 09534400 (CAS 701226-86-0), with molecular formula C16H16N4O3S and molecular weight 344.09 g/mol. IUPAC: N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of BAS 09534400
Property Insights of BAS 09534400
The XLogP value of 3.29032 indicates that BAS 09534400 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.14 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09534400. Following Lipinski's Rule of Five, BAS 09534400 has 1 hydrogen bond donor(s) and 7 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 BAS 09534400?
The CAS number of BAS 09534400 is 701226-86-0.
What is the molecular formula of BAS 09534400?
The molecular formula of BAS 09534400 is C16H16N4O3S.
What is the molecular weight of BAS 09534400?
The molecular weight of BAS 09534400 is 344.09 g/mol.
Where can I buy BAS 09534400?
You can request a quote for BAS 09534400 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09534400?
Yes, KEHONG BIO provides custom synthesis services for BAS 09534400 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.