BAS 06259956
TL;DR: BAS 06259956 (CAS 617694-16-3) is a chemical compound with molecular formula C21H23N3O5S and molecular weight 429.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[1-[2-(dimethylamino)ethyl]-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-2-yl]phenoxy]acetamide
Also Known As: BAS 06259956, AB00314476-02, AS-871/41898828, 2-(4-(1-(2-(dimethylamino)ethyl)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2,5-dihydro-1H-pyrrol-2-yl)phenoxy)acetamide, F1423-0565
| Molecular Formula | C21H23N3O5S |
|---|---|
| Molecular Weight | 429.14 g/mol |
| LogP | 1.7521 |
| Topological Polar Surface Area | 113.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 429.13583 |
| Heavy Atoms | 30 |
| Complexity | 967.03784 |
Chemical Identifiers
| CAS Number | 617694-16-3 |
|---|---|
| SMILES | CN(C)CCN1C(C(=C(C1=O)O)C(=O)C2=CC=CS2)C3=CC=C(C=C3)OCC(=O)N |
Product Overview
BAS 06259956 (CAS 617694-16-3), with molecular formula C21H23N3O5S and molecular weight 429.14 g/mol. IUPAC: 2-[4-[1-[2-(dimethylamino)ethyl]-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-2-yl]phenoxy]acetamide.
Chemical Property Profile of BAS 06259956
Property Insights of BAS 06259956
The XLogP value of 1.7521 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06259956. The TPSA of 113.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06259956. Following Lipinski's Rule of Five, BAS 06259956 has 2 hydrogen bond donor(s) and 7 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 06259956?
The CAS number of BAS 06259956 is 617694-16-3.
What is the molecular formula of BAS 06259956?
The molecular formula of BAS 06259956 is C21H23N3O5S.
What is the molecular weight of BAS 06259956?
The molecular weight of BAS 06259956 is 429.14 g/mol.
Where can I buy BAS 06259956?
You can request a quote for BAS 06259956 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06259956?
Yes, KEHONG BIO provides custom synthesis services for BAS 06259956 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.