BAS 03058142
TL;DR: BAS 03058142 (CAS 333758-14-8) is a chemical compound with molecular formula C16H13BrN4O2S2 and molecular weight 435.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-[4-[(E)-2-(5-bromothiophen-2-yl)ethenyl]pyrimidin-2-yl]benzenesulfonamide
Also Known As: BAS 03058142, BRD-K45414778-001-07-0, 4-amino-N-[4-[(E)-2-(5-bromothiophen-2-yl)ethenyl]pyrimidin-2-yl]benzenesulfonamide, 4-amino-N-{4-[(E)-2-(5-bromothiophen-2-yl)ethenyl]pyrimidin-2-yl}benzenesulfonamide, (E)-4-amino-N-(4-(2-(5-bromothiophen-2-yl)vinyl)pyrimidin-2-yl)benzenesulfonamide
| Molecular Formula | C16H13BrN4O2S2 |
|---|---|
| Molecular Weight | 435.97 g/mol |
| LogP | 3.854 |
| Topological Polar Surface Area | 97.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 435.96634 |
| Heavy Atoms | 25 |
| Complexity | 1014.6238 |
Chemical Identifiers
| CAS Number | 333758-14-8 |
|---|---|
| SMILES | C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CC(=N2)/C=C/C3=CC=C(S3)Br |
Product Overview
BAS 03058142 (CAS 333758-14-8), with molecular formula C16H13BrN4O2S2 and molecular weight 435.97 g/mol. IUPAC: 4-amino-N-[4-[(E)-2-(5-bromothiophen-2-yl)ethenyl]pyrimidin-2-yl]benzenesulfonamide.
Chemical Property Profile of BAS 03058142
Property Insights of BAS 03058142
The XLogP value of 3.854 indicates that BAS 03058142 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.97 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03058142. Following Lipinski's Rule of Five, BAS 03058142 has 2 hydrogen bond donor(s) and 6 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 03058142?
The CAS number of BAS 03058142 is 333758-14-8.
What is the molecular formula of BAS 03058142?
The molecular formula of BAS 03058142 is C16H13BrN4O2S2.
What is the molecular weight of BAS 03058142?
The molecular weight of BAS 03058142 is 435.97 g/mol.
Where can I buy BAS 03058142?
You can request a quote for BAS 03058142 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03058142?
Yes, KEHONG BIO provides custom synthesis services for BAS 03058142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.