ChemDiv1_018523
TL;DR: ChemDiv1_018523 (CAS 313380-11-9) is a chemical compound with molecular formula C22H15F3N2O2S and molecular weight 428.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-amino-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]-(4-methoxyphenyl)methanone
Also Known As: ChemDiv1_018523, [3-amino-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]-(4-methoxyphenyl)methanone, [3-amino-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl](4-methoxyphenyl)methanone, (3-amino-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl)(4-methoxyphenyl)methanone, 2-(4-METHOXYBENZOYL)-6-PHENYL-4-(TRIFLUOROMETHYL)THIENO[2,3-B]PYRIDIN-3-AMINE
| Molecular Formula | C22H15F3N2O2S |
|---|---|
| Molecular Weight | 428.08 g/mol |
| LogP | 5.8039 |
| Topological Polar Surface Area | 65.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.08063 |
| Heavy Atoms | 30 |
| Complexity | 1233.4603 |
Chemical Identifiers
| CAS Number | 313380-11-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C2=C(C3=C(S2)N=C(C=C3C(F)(F)F)C4=CC=CC=C4)N |
Product Overview
ChemDiv1_018523 (CAS 313380-11-9), with molecular formula C22H15F3N2O2S and molecular weight 428.08 g/mol. IUPAC: [3-amino-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]-(4-methoxyphenyl)methanone.
Chemical Property Profile of ChemDiv1_018523
Property Insights of ChemDiv1_018523
The XLogP value of 5.8039 indicates that ChemDiv1_018523 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.21 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_018523. Following Lipinski's Rule of Five, ChemDiv1_018523 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_018523?
The CAS number of ChemDiv1_018523 is 313380-11-9.
What is the molecular formula of ChemDiv1_018523?
The molecular formula of ChemDiv1_018523 is C22H15F3N2O2S.
What is the molecular weight of ChemDiv1_018523?
The molecular weight of ChemDiv1_018523 is 428.08 g/mol.
Where can I buy ChemDiv1_018523?
You can request a quote for ChemDiv1_018523 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_018523?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_018523 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.