BAS 06901184
TL;DR: BAS 06901184 (CAS 625377-56-2) is a chemical compound with molecular formula C14H15F3N2OS and molecular weight 316.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,3-dimethyl-2-oxobutyl)sulfanyl-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: BAS 06901184, 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile, AM-807/41463656, 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-6-methyl-4-(trifluoromethyl)nicotinonitrile, 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile
| Molecular Formula | C14H15F3N2OS |
|---|---|
| Molecular Weight | 316.09 g/mol |
| LogP | 3.9878 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.08572 |
| Heavy Atoms | 21 |
| Complexity | 597.9525 |
Chemical Identifiers
| CAS Number | 625377-56-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)SCC(=O)C(C)(C)C)C#N)C(F)(F)F |
Product Overview
BAS 06901184 (CAS 625377-56-2), with molecular formula C14H15F3N2OS and molecular weight 316.09 g/mol. IUPAC: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile.
Chemical Property Profile of BAS 06901184
Property Insights of BAS 06901184
The XLogP value of 3.9878 indicates that BAS 06901184 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.75 Ų, BAS 06901184 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 06901184 has 0 hydrogen bond donor(s) and 4 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 06901184?
The CAS number of BAS 06901184 is 625377-56-2.
What is the molecular formula of BAS 06901184?
The molecular formula of BAS 06901184 is C14H15F3N2OS.
What is the molecular weight of BAS 06901184?
The molecular weight of BAS 06901184 is 316.09 g/mol.
Where can I buy BAS 06901184?
You can request a quote for BAS 06901184 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06901184?
Yes, KEHONG BIO provides custom synthesis services for BAS 06901184 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.