BAS 02102898
TL;DR: BAS 02102898 (CAS 340272-41-5) is a chemical compound with molecular formula C22H20N4O2S and molecular weight 404.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethylpyrrol-3-yl]-N-(furan-2-ylmethyl)prop-2-enamide
Also Known As: BAS 02102898, (2E)-2-cyano-3-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-N-(furan-2-ylmethyl)prop-2-enamide, (E)-2-cyano-3-(1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl)-N-(furan-2-ylmethyl)acrylamide, (2E)-2-cyano-3-[1-(3-cyano-4,5-dimethyl(2-thienyl))-2,5-dimethylpyrrol-3-yl]-N -(2-furylmethyl)prop-2-enamide, (E)-2-cyano-3-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethylpyrrol-3-yl]-N-(furan-2-ylmethyl)prop-2-enamide
| Molecular Formula | C22H20N4O2S |
|---|---|
| Molecular Weight | 404.13 g/mol |
| LogP | 4.46054 |
| Topological Polar Surface Area | 94.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.1307 |
| Heavy Atoms | 29 |
| Complexity | 1181.1979 |
Chemical Identifiers
| CAS Number | 340272-41-5 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=C(C(=C(S2)C)C)C#N)C)/C=C(\C#N)/C(=O)NCC3=CC=CO3 |
Product Overview
BAS 02102898 (CAS 340272-41-5), with molecular formula C22H20N4O2S and molecular weight 404.13 g/mol. IUPAC: (E)-2-cyano-3-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethylpyrrol-3-yl]-N-(furan-2-ylmethyl)prop-2-enamide.
Chemical Property Profile of BAS 02102898
Property Insights of BAS 02102898
The XLogP value of 4.46054 indicates that BAS 02102898 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02102898. Following Lipinski's Rule of Five, BAS 02102898 has 1 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 02102898?
The CAS number of BAS 02102898 is 340272-41-5.
What is the molecular formula of BAS 02102898?
The molecular formula of BAS 02102898 is C22H20N4O2S.
What is the molecular weight of BAS 02102898?
The molecular weight of BAS 02102898 is 404.13 g/mol.
Where can I buy BAS 02102898?
You can request a quote for BAS 02102898 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02102898?
Yes, KEHONG BIO provides custom synthesis services for BAS 02102898 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.