BAS 13320674
TL;DR: BAS 13320674 (CAS 887693-95-0) is a chemical compound with molecular formula C21H22ClN3O4 and molecular weight 415.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-4-methylbenzamide
Also Known As: BAS 13320674, 3-chloro-N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-N-ethyl-4-methylbenzamide, 3-chloro-N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-4-methylbenzamide, 3-chloro-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-ethyl-4-methylbenzamide
| Molecular Formula | C21H22ClN3O4 |
|---|---|
| Molecular Weight | 415.13 g/mol |
| LogP | 4.37792 |
| Topological Polar Surface Area | 77.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.12988 |
| Heavy Atoms | 29 |
| Complexity | 1018.9108 |
Chemical Identifiers
| CAS Number | 887693-95-0 |
|---|---|
| SMILES | CCN(CC1=NC(=NO1)C2=CC(=C(C=C2)OC)OC)C(=O)C3=CC(=C(C=C3)C)Cl |
Product Overview
BAS 13320674 (CAS 887693-95-0), with molecular formula C21H22ClN3O4 and molecular weight 415.13 g/mol. IUPAC: 3-chloro-N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-4-methylbenzamide.
Chemical Property Profile of BAS 13320674
Property Insights of BAS 13320674
The XLogP value of 4.37792 indicates that BAS 13320674 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.69 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13320674. Following Lipinski's Rule of Five, BAS 13320674 has 0 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 13320674?
The CAS number of BAS 13320674 is 887693-95-0.
What is the molecular formula of BAS 13320674?
The molecular formula of BAS 13320674 is C21H22ClN3O4.
What is the molecular weight of BAS 13320674?
The molecular weight of BAS 13320674 is 415.13 g/mol.
Where can I buy BAS 13320674?
You can request a quote for BAS 13320674 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13320674?
Yes, KEHONG BIO provides custom synthesis services for BAS 13320674 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.