AB01305691-01
TL;DR: AB01305691-01 (CAS 845801-32-3) is a chemical compound with molecular formula C17H18Cl2N4O2 and molecular weight 380.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,4-dichlorophenoxy)methyl]-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
Also Known As: AB01305691-01, 2-[(2,4-dichlorophenoxy)methyl]-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile, 2-((2,4-dichlorophenoxy)methyl)-5-(4-ethylpiperazin-1-yl)oxazole-4-carbonitrile
| Molecular Formula | C17H18Cl2N4O2 |
|---|---|
| Molecular Weight | 380.08 g/mol |
| LogP | 3.57398 |
| Topological Polar Surface Area | 65.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.0807 |
| Heavy Atoms | 25 |
| Complexity | 779.4404 |
Chemical Identifiers
| CAS Number | 845801-32-3 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=C(N=C(O2)COC3=C(C=C(C=C3)Cl)Cl)C#N |
Product Overview
AB01305691-01 (CAS 845801-32-3), with molecular formula C17H18Cl2N4O2 and molecular weight 380.08 g/mol. IUPAC: 2-[(2,4-dichlorophenoxy)methyl]-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of AB01305691-01
Property Insights of AB01305691-01
The XLogP value of 3.57398 indicates that AB01305691-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.53 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01305691-01. Following Lipinski's Rule of Five, AB01305691-01 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 AB01305691-01?
The CAS number of AB01305691-01 is 845801-32-3.
What is the molecular formula of AB01305691-01?
The molecular formula of AB01305691-01 is C17H18Cl2N4O2.
What is the molecular weight of AB01305691-01?
The molecular weight of AB01305691-01 is 380.08 g/mol.
Where can I buy AB01305691-01?
You can request a quote for AB01305691-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01305691-01?
Yes, KEHONG BIO provides custom synthesis services for AB01305691-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.