BAS 02323774
TL;DR: BAS 02323774 (CAS 335397-61-0) is a chemical compound with molecular formula C20H23N5O4S3 and molecular weight 493.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
Also Known As: BAS 02323774, ethyl 2-({[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)-4,5-dimethylthiophene-3-carboxylate, ethyl 2-(2-((5-(((4,6-dimethylpyrimidin-2-yl)thio)methyl)-1,3,4-oxadiazol-2-yl)thio)acetamido)-4,5-dimethylthiophene-3-carboxylate, ethyl 2-(2-{5-[(4,6-dimethylpyrimidin-2-ylthio)methyl](1,3,4-oxadiazol-2-ylthi o)}acetylamino)-4,5-dimethylthiophene-3-carboxylate, ethyl 2-[[2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
| Molecular Formula | C20H23N5O4S3 |
|---|---|
| Molecular Weight | 493.09 g/mol |
| LogP | 4.35458 |
| Topological Polar Surface Area | 120.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 493.09122 |
| Heavy Atoms | 32 |
| Complexity | 1108.3859 |
Chemical Identifiers
| CAS Number | 335397-61-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(O2)CSC3=NC(=CC(=N3)C)C |
Product Overview
BAS 02323774 (CAS 335397-61-0), with molecular formula C20H23N5O4S3 and molecular weight 493.09 g/mol. IUPAC: ethyl 2-[[2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate.
Chemical Property Profile of BAS 02323774
Property Insights of BAS 02323774
The XLogP value of 4.35458 indicates that BAS 02323774 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02323774. Following Lipinski's Rule of Five, BAS 02323774 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02323774?
The CAS number of BAS 02323774 is 335397-61-0.
What is the molecular formula of BAS 02323774?
The molecular formula of BAS 02323774 is C20H23N5O4S3.
What is the molecular weight of BAS 02323774?
The molecular weight of BAS 02323774 is 493.09 g/mol.
Where can I buy BAS 02323774?
You can request a quote for BAS 02323774 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02323774?
Yes, KEHONG BIO provides custom synthesis services for BAS 02323774 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.