BAS 13322277
TL;DR: BAS 13322277 (CAS 838866-70-9) is a chemical compound with molecular formula C17H12ClN3O4 and molecular weight 357.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,3-benzodioxole-5-carboxamide
Also Known As: BAS 13322277, N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,3-benzodioxole-5-carboxamide, N-((3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl)methyl)benzo[d][1,3]dioxole-5-carboxamide, N-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-benzodioxole-5-carboxamide, Benzo[1,3]dioxole-5-carboxylic acid [3-(4-chloro-phenyl)-[1,2,4]oxadiazol-5-ylmethyl]-amide
| Molecular Formula | C17H12ClN3O4 |
|---|---|
| Molecular Weight | 357.05 g/mol |
| LogP | 3.0487 |
| Topological Polar Surface Area | 86.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.05164 |
| Heavy Atoms | 25 |
| Complexity | 923.89734 |
Chemical Identifiers
| CAS Number | 838866-70-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)NCC3=NC(=NO3)C4=CC=C(C=C4)Cl |
Product Overview
BAS 13322277 (CAS 838866-70-9), with molecular formula C17H12ClN3O4 and molecular weight 357.05 g/mol. IUPAC: N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of BAS 13322277
Property Insights of BAS 13322277
The XLogP value of 3.0487 indicates that BAS 13322277 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13322277. Following Lipinski's Rule of Five, BAS 13322277 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 BAS 13322277?
The CAS number of BAS 13322277 is 838866-70-9.
What is the molecular formula of BAS 13322277?
The molecular formula of BAS 13322277 is C17H12ClN3O4.
What is the molecular weight of BAS 13322277?
The molecular weight of BAS 13322277 is 357.05 g/mol.
Where can I buy BAS 13322277?
You can request a quote for BAS 13322277 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13322277?
Yes, KEHONG BIO provides custom synthesis services for BAS 13322277 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.