BAS 07094067
TL;DR: BAS 07094067 (CAS 309289-81-4) is a chemical compound with molecular formula C16H18N4OS and molecular weight 314.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-3-tert-butyl-4-(5-methylthiophen-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: BAS 07094067, 6-amino-3-tert-butyl-4-(5-methyl-2-thienyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, AB00092691-01, 6-amino-3-tert-butyl-4-(5-methylthiophen-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, A2161/0090782
| Molecular Formula | C16H18N4OS |
|---|---|
| Molecular Weight | 314.12 g/mol |
| LogP | 3.2953 |
| Topological Polar Surface Area | 87.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.12012 |
| Heavy Atoms | 22 |
| Complexity | 800.95795 |
Chemical Identifiers
| CAS Number | 309289-81-4 |
|---|---|
| SMILES | CC1=CC=C(S1)C2C(=C(OC3=NNC(=C23)C(C)(C)C)N)C#N |
Product Overview
BAS 07094067 (CAS 309289-81-4), with molecular formula C16H18N4OS and molecular weight 314.12 g/mol. IUPAC: 6-amino-3-tert-butyl-4-(5-methylthiophen-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of BAS 07094067
Property Insights of BAS 07094067
The XLogP value of 3.2953 indicates that BAS 07094067 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.72 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07094067. Following Lipinski's Rule of Five, BAS 07094067 has 2 hydrogen bond donor(s) and 5 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 07094067?
The CAS number of BAS 07094067 is 309289-81-4.
What is the molecular formula of BAS 07094067?
The molecular formula of BAS 07094067 is C16H18N4OS.
What is the molecular weight of BAS 07094067?
The molecular weight of BAS 07094067 is 314.12 g/mol.
Where can I buy BAS 07094067?
You can request a quote for BAS 07094067 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07094067?
Yes, KEHONG BIO provides custom synthesis services for BAS 07094067 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.