BAS 01213211
TL;DR: BAS 01213211 (CAS 332160-29-9) is a chemical compound with molecular formula C17H13ClN4O5S and molecular weight 420.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-methoxy-4-nitrophenyl)acetamide
Also Known As: BAS 01213211, 2-((5-(2-Chlorophenyl)-1,3,4-oxadiazol-2-yl)thio)-N-(2-methoxy-4-nitrophenyl)acetamide, 2-[5-(2-chlorophenyl)(1,3,4-oxadiazol-2-ylthio)]-N-(2-methoxy-4-nitrophenyl)ac etamide, 2-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-methoxy-4-nitrophenyl)acetamide, 2-[5-(2-Chloro-phenyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-N-(2-methoxy-4-nitro-phenyl)-acetamide
| Molecular Formula | C17H13ClN4O5S |
|---|---|
| Molecular Weight | 420.03 g/mol |
| LogP | 4.0376 |
| Topological Polar Surface Area | 120.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.0295 |
| Heavy Atoms | 28 |
| Complexity | 1026.2872 |
Chemical Identifiers
| CAS Number | 332160-29-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NN=C(O2)C3=CC=CC=C3Cl |
Product Overview
BAS 01213211 (CAS 332160-29-9), with molecular formula C17H13ClN4O5S and molecular weight 420.03 g/mol. IUPAC: 2-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-methoxy-4-nitrophenyl)acetamide.
Chemical Property Profile of BAS 01213211
Property Insights of BAS 01213211
The XLogP value of 4.0376 indicates that BAS 01213211 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01213211. Following Lipinski's Rule of Five, BAS 01213211 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 BAS 01213211?
The CAS number of BAS 01213211 is 332160-29-9.
What is the molecular formula of BAS 01213211?
The molecular formula of BAS 01213211 is C17H13ClN4O5S.
What is the molecular weight of BAS 01213211?
The molecular weight of BAS 01213211 is 420.03 g/mol.
Where can I buy BAS 01213211?
You can request a quote for BAS 01213211 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01213211?
Yes, KEHONG BIO provides custom synthesis services for BAS 01213211 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.