BAS 01104039
TL;DR: BAS 01104039 (CAS 309278-45-3) is a chemical compound with molecular formula C25H18N2O2S2 and molecular weight 442.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-(4-methoxyphenyl)methanone
Also Known As: BAS 01104039, (3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-(4-methoxyphenyl)methanone, BRD-K23628665-001-01-0, [3-amino-4-phenyl-6-(2-thienyl)thieno[2,3-b]pyridin-2-yl](4-methoxyphenyl)methanone, A2128/0089343
| Molecular Formula | C25H18N2O2S2 |
|---|---|
| Molecular Weight | 442.08 g/mol |
| LogP | 6.5136 |
| Topological Polar Surface Area | 65.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.08096 |
| Heavy Atoms | 31 |
| Complexity | 1373.1097 |
Chemical Identifiers
| CAS Number | 309278-45-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C2=C(C3=C(S2)N=C(C=C3C4=CC=CC=C4)C5=CC=CS5)N |
Product Overview
BAS 01104039 (CAS 309278-45-3), with molecular formula C25H18N2O2S2 and molecular weight 442.08 g/mol. IUPAC: (3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-(4-methoxyphenyl)methanone.
Chemical Property Profile of BAS 01104039
Property Insights of BAS 01104039
The XLogP value of 6.5136 indicates that BAS 01104039 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 BAS 01104039. Following Lipinski's Rule of Five, BAS 01104039 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01104039?
The CAS number of BAS 01104039 is 309278-45-3.
What is the molecular formula of BAS 01104039?
The molecular formula of BAS 01104039 is C25H18N2O2S2.
What is the molecular weight of BAS 01104039?
The molecular weight of BAS 01104039 is 442.08 g/mol.
Where can I buy BAS 01104039?
You can request a quote for BAS 01104039 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01104039?
Yes, KEHONG BIO provides custom synthesis services for BAS 01104039 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.