BAS 06899772
TL;DR: BAS 06899772 (CAS 445265-91-8) is a chemical compound with molecular formula C22H28N4O3 and molecular weight 396.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-3-tert-butyl-4-(3-ethoxy-4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: BAS 06899772, 6-amino-3-(1,1-dimethylethyl)-4-[3-(ethyloxy)-4-(propyloxy)phenyl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, AM-807/12740021, 6-amino-3-tert-butyl-4-(3-ethoxy-4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-(tert-butyl)-4-(3-ethoxy-4-propoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C22H28N4O3 |
|---|---|
| Molecular Weight | 396.22 g/mol |
| LogP | 4.11288 |
| Topological Polar Surface Area | 106.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.21616 |
| Heavy Atoms | 29 |
| Complexity | 963.4126 |
Chemical Identifiers
| CAS Number | 445265-91-8 |
|---|---|
| SMILES | CCCOC1=C(C=C(C=C1)C2C(=C(OC3=NNC(=C23)C(C)(C)C)N)C#N)OCC |
Product Overview
BAS 06899772 (CAS 445265-91-8), with molecular formula C22H28N4O3 and molecular weight 396.22 g/mol. IUPAC: 6-amino-3-tert-butyl-4-(3-ethoxy-4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of BAS 06899772
Property Insights of BAS 06899772
The XLogP value of 4.11288 indicates that BAS 06899772 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06899772. Following Lipinski's Rule of Five, BAS 06899772 has 2 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 06899772?
The CAS number of BAS 06899772 is 445265-91-8.
What is the molecular formula of BAS 06899772?
The molecular formula of BAS 06899772 is C22H28N4O3.
What is the molecular weight of BAS 06899772?
The molecular weight of BAS 06899772 is 396.22 g/mol.
Where can I buy BAS 06899772?
You can request a quote for BAS 06899772 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06899772?
Yes, KEHONG BIO provides custom synthesis services for BAS 06899772 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.