5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt
TL;DR: 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt (CAS 6578-06-9) is a chemical compound with molecular formula C15H15BrClN2O4P and molecular weight 431.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-bromo-4-chloro-1H-indol-3-yl) dihydrogen phosphate;4-methylaniline
Also Known As: BCIP, BCIP p-toluidine salt, X-phosphate, 5-Bromo-4-chloro-3-indolyl phosphate p-toluidine salt, BCIP ptoluidine salt
| Molecular Formula | C15H15BrClN2O4P |
|---|---|
| Molecular Weight | 431.96 g/mol |
| LogP | 4.63 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 431.96414 |
| Heavy Atoms | 24 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 6578-06-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N.C1=CC(=C(C2=C1NC=C2OP(=O)(O)O)Cl)Br |
| InChIKey | QEIFSLUFHRCVQL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt (CAS 6578-06-9), with molecular formula C15H15BrClN2O4P and molecular weight 431.96 g/mol. IUPAC: (5-bromo-4-chloro-1H-indol-3-yl) dihydrogen phosphate;4-methylaniline.
Chemical Property Profile of 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt
Property Insights of 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt
The XLogP value of 4.63 indicates that 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt. Following Lipinski's Rule of Five, 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt has 4 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 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt?
The CAS number of 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt is 6578-06-9.
What is the molecular formula of 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt?
The molecular formula of 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt is C15H15BrClN2O4P.
What is the molecular weight of 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt?
The molecular weight of 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt is 431.96 g/mol.
Where can I buy 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt?
You can request a quote for 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-4-chloro-3-indolyl phosphate, p-toluidine salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.