A2852/0120332
TL;DR: A2852/0120332 (CAS 442672-16-4) is a chemical compound with molecular formula C25H21BrClNO5S and molecular weight 561.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenylindole-3-carboxylate
Also Known As: A2852/0120332, ethyl 6-bromo-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenylindole-3-carboxylate, ethyl 6-bromo-2-(((4-chlorophenyl)sulfonyl)methyl)-5-methoxy-1-phenyl-1H-indole-3-carboxylate, ethyl 6-bromo-2-{[(4-chlorophenyl)sulfonyl]methyl}-5-methoxy-1-phenylindole-3- carboxylate, ETHYL 6-BROMO-2-[(4-CHLOROBENZENESULFONYL)METHYL]-5-METHOXY-1-PHENYL-1H-INDOLE-3-CARBOXYLATE
| Molecular Formula | C25H21BrClNO5S |
|---|---|
| Molecular Weight | 561.00 g/mol |
| LogP | 6.2056 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 561.0012 |
| Heavy Atoms | 34 |
| Complexity | 1465.2208 |
Chemical Identifiers
| CAS Number | 442672-16-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CS(=O)(=O)C4=CC=C(C=C4)Cl |
Product Overview
A2852/0120332 (CAS 442672-16-4), with molecular formula C25H21BrClNO5S and molecular weight 561.00 g/mol. IUPAC: ethyl 6-bromo-2-[(4-chlorophenyl)sulfonylmethyl]-5-methoxy-1-phenylindole-3-carboxylate.
Chemical Property Profile of A2852/0120332
Property Insights of A2852/0120332
The XLogP value of 6.2056 indicates that A2852/0120332 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for A2852/0120332. Following Lipinski's Rule of Five, A2852/0120332 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2852/0120332?
The CAS number of A2852/0120332 is 442672-16-4.
What is the molecular formula of A2852/0120332?
The molecular formula of A2852/0120332 is C25H21BrClNO5S.
What is the molecular weight of A2852/0120332?
The molecular weight of A2852/0120332 is 561.00 g/mol.
Where can I buy A2852/0120332?
You can request a quote for A2852/0120332 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2852/0120332?
Yes, KEHONG BIO provides custom synthesis services for A2852/0120332 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.