BAS 00896883
TL;DR: BAS 00896883 (CAS 328532-33-8) is a chemical compound with molecular formula C20H16ClN5O3 and molecular weight 409.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-3-[(Z)-2-[5-(5-chloro-2-methoxyphenyl)furan-2-yl]-1-cyanoethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile
Also Known As: BAS 00896883, A1896/0079588, 5-amino-3-[(Z)-2-[5-(5-chloro-2-methoxyphenyl)furan-2-yl]-1-cyanoethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile, 5-amino-3-{(Z)-2-[5-(5-chloro-2-methoxyphenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile, 5-AMINO-3-[(1Z)-2-[5-(5-CHLORO-2-METHOXYPHENYL)FURAN-2-YL]-1-CYANOETH-1-EN-1-YL]-1-(2-HYDROXYETHYL)-1H-PYRAZOLE-4-CARBONITRILE
| Molecular Formula | C20H16ClN5O3 |
|---|---|
| Molecular Weight | 409.09 g/mol |
| LogP | 3.31546 |
| Topological Polar Surface Area | 134.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.09418 |
| Heavy Atoms | 29 |
| Complexity | 1163.9731 |
Chemical Identifiers
| CAS Number | 328532-33-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)C2=CC=C(O2)/C=C(\C#N)/C3=NN(C(=C3C#N)N)CCO |
Product Overview
BAS 00896883 (CAS 328532-33-8), with molecular formula C20H16ClN5O3 and molecular weight 409.09 g/mol. IUPAC: 5-amino-3-[(Z)-2-[5-(5-chloro-2-methoxyphenyl)furan-2-yl]-1-cyanoethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile.
Chemical Property Profile of BAS 00896883
Property Insights of BAS 00896883
The XLogP value of 3.31546 indicates that BAS 00896883 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00896883. Following Lipinski's Rule of Five, BAS 00896883 has 2 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 00896883?
The CAS number of BAS 00896883 is 328532-33-8.
What is the molecular formula of BAS 00896883?
The molecular formula of BAS 00896883 is C20H16ClN5O3.
What is the molecular weight of BAS 00896883?
The molecular weight of BAS 00896883 is 409.09 g/mol.
Where can I buy BAS 00896883?
You can request a quote for BAS 00896883 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00896883?
Yes, KEHONG BIO provides custom synthesis services for BAS 00896883 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.