BAS 13319231
TL;DR: BAS 13319231 (CAS 879577-33-0) is a chemical compound with molecular formula C22H25N3O5 and molecular weight 411.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methoxy-N-propan-2-ylbenzamide
Also Known As: BAS 13319231, AO-022/43455053, N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methoxy-N-propan-2-ylbenzamide, N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-isopropyl-2-methoxybenzamide, N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-N-isopropyl-2-methoxybenzamide
| Molecular Formula | C22H25N3O5 |
|---|---|
| Molecular Weight | 411.18 g/mol |
| LogP | 3.8132 |
| Topological Polar Surface Area | 86.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 411.1794 |
| Heavy Atoms | 30 |
| Complexity | 1015.5125 |
Chemical Identifiers
| CAS Number | 879577-33-0 |
|---|---|
| SMILES | CC(C)N(CC1=NC(=NO1)C2=CC(=C(C=C2)OC)OC)C(=O)C3=CC=CC=C3OC |
Product Overview
BAS 13319231 (CAS 879577-33-0), with molecular formula C22H25N3O5 and molecular weight 411.18 g/mol. IUPAC: N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methoxy-N-propan-2-ylbenzamide.
Chemical Property Profile of BAS 13319231
Property Insights of BAS 13319231
The XLogP value of 3.8132 indicates that BAS 13319231 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.92 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13319231. Following Lipinski's Rule of Five, BAS 13319231 has 0 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 13319231?
The CAS number of BAS 13319231 is 879577-33-0.
What is the molecular formula of BAS 13319231?
The molecular formula of BAS 13319231 is C22H25N3O5.
What is the molecular weight of BAS 13319231?
The molecular weight of BAS 13319231 is 411.18 g/mol.
Where can I buy BAS 13319231?
You can request a quote for BAS 13319231 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13319231?
Yes, KEHONG BIO provides custom synthesis services for BAS 13319231 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.