ChemDiv1_003431
TL;DR: ChemDiv1_003431 (CAS 337347-02-1) is a chemical compound with molecular formula C16H18BrN3O3S and molecular weight 411.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-bromo-4-methoxy-6-methylpyrimidin-2-yl)-4-methyl-N-prop-2-enylbenzenesulfonamide
Also Known As: ChemDiv1_003431, BAS 01258092, AJ-292/13328021, N-(5-bromo-4-methoxy-6-methylpyrimidin-2-yl)-4-methyl-N-(prop-2-en-1-yl)benzenesulfonamide, (5-bromo-6-methoxy-4-methylpyrimidin-2-yl)[(4-methylphenyl)sulfonyl]prop-2-eny lamine
| Molecular Formula | C16H18BrN3O3S |
|---|---|
| Molecular Weight | 411.03 g/mol |
| LogP | 3.24584 |
| Topological Polar Surface Area | 72.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.02524 |
| Heavy Atoms | 24 |
| Complexity | 851.6165 |
Chemical Identifiers
| CAS Number | 337347-02-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(CC=C)C2=NC(=C(C(=N2)OC)Br)C |
Product Overview
ChemDiv1_003431 (CAS 337347-02-1), with molecular formula C16H18BrN3O3S and molecular weight 411.03 g/mol. IUPAC: N-(5-bromo-4-methoxy-6-methylpyrimidin-2-yl)-4-methyl-N-prop-2-enylbenzenesulfonamide.
Chemical Property Profile of ChemDiv1_003431
Property Insights of ChemDiv1_003431
The XLogP value of 3.24584 indicates that ChemDiv1_003431 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.39 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003431. Following Lipinski's Rule of Five, ChemDiv1_003431 has 0 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 ChemDiv1_003431?
The CAS number of ChemDiv1_003431 is 337347-02-1.
What is the molecular formula of ChemDiv1_003431?
The molecular formula of ChemDiv1_003431 is C16H18BrN3O3S.
What is the molecular weight of ChemDiv1_003431?
The molecular weight of ChemDiv1_003431 is 411.03 g/mol.
Where can I buy ChemDiv1_003431?
You can request a quote for ChemDiv1_003431 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003431?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003431 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.