RefChem:519174
TL;DR: RefChem:519174 (CAS 477733-86-1) is a chemical compound with molecular formula C29H21BrClN3O5S and molecular weight 637.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-bromo-2-[(E)-[[2-[(4-chlorophenyl)sulfonylamino]benzoyl]hydrazinylidene]methyl]phenyl] (E)-3-phenylprop-2-enoate
Also Known As: 4-BROMO-2-{(E)-[(2-{[(4-CHLOROPHENYL)SULFONYL]AMINO}BENZOYL)HYDRAZONO]METHYL}PHENYL (2E)-3-PHENYL-2-PROPENOATE, 4-BROMO-2-((E)-((2-(((4-CHLOROPHENYL)SULFONYL)AMINO)BENZOYL)HYDRAZONO)METHYL)PHENYL (2E)-3-PHENYL-2-PROPENOATE, 647-251-8, RefChem:519174
| Molecular Formula | C29H21BrClN3O5S |
|---|---|
| Molecular Weight | 637.01 g/mol |
| LogP | 6.286 |
| Topological Polar Surface Area | 113.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 637.0074 |
| Heavy Atoms | 40 |
| Complexity | 1692.7773 |
Chemical Identifiers
| CAS Number | 477733-86-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)Cl |
Product Overview
RefChem:519174 (CAS 477733-86-1), with molecular formula C29H21BrClN3O5S and molecular weight 637.01 g/mol. IUPAC: [4-bromo-2-[(E)-[[2-[(4-chlorophenyl)sulfonylamino]benzoyl]hydrazinylidene]methyl]phenyl] (E)-3-phenylprop-2-enoate.
Chemical Property Profile of RefChem:519174
Property Insights of RefChem:519174
The XLogP value of 6.286 indicates that RefChem:519174 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.93 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:519174. Following Lipinski's Rule of Five, RefChem:519174 has 2 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 RefChem:519174?
The CAS number of RefChem:519174 is 477733-86-1.
What is the molecular formula of RefChem:519174?
The molecular formula of RefChem:519174 is C29H21BrClN3O5S.
What is the molecular weight of RefChem:519174?
The molecular weight of RefChem:519174 is 637.01 g/mol.
Where can I buy RefChem:519174?
You can request a quote for RefChem:519174 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:519174?
Yes, KEHONG BIO provides custom synthesis services for RefChem:519174 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.