尼罗蓝盐酸盐
TL;DR: 尼罗蓝盐酸盐 (CAS 2381-85-3) is a chemical compound with molecular formula C20H20ClN3O and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尼罗蓝盐酸盐
(5-aminobenzo[a]phenoxazin-9-ylidene)-diethylazanium chloride
Also Known As: Nile Blue chloride, Nile blue, Basic Blue 12, Nile Blue A, Cresol Fast Violet
| Molecular Formula | C20H20ClN3O |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | 0.48 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.1295 |
| Heavy Atoms | 25 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 2381-85-3 |
|---|---|
| SMILES | CC[N+](=C1C=CC2=NC3=C(C=C(C4=CC=CC=C43)N)OC2=C1)CC.[Cl-] |
| InChIKey | SHXOKQKTZJXHHR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
尼罗蓝盐酸盐 (CAS 2381-85-3), with molecular formula C20H20ClN3O and molecular weight 353.13 g/mol. IUPAC: (5-aminobenzo[a]phenoxazin-9-ylidene)-diethylazanium chloride.
Chemical Property Profile of 尼罗蓝盐酸盐
Property Insights of 尼罗蓝盐酸盐
The XLogP value of 0.48 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 尼罗蓝盐酸盐. With a topological polar surface area (TPSA) of 50.6 Ų, 尼罗蓝盐酸盐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 尼罗蓝盐酸盐 has 1 hydrogen bond donor(s) and 4 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 尼罗蓝盐酸盐?
The CAS number of 尼罗蓝盐酸盐 is 2381-85-3.
What is the molecular formula of 尼罗蓝盐酸盐?
The molecular formula of 尼罗蓝盐酸盐 is C20H20ClN3O.
What is the molecular weight of 尼罗蓝盐酸盐?
The molecular weight of 尼罗蓝盐酸盐 is 353.13 g/mol.
Where can I buy 尼罗蓝盐酸盐?
You can request a quote for 尼罗蓝盐酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尼罗蓝盐酸盐?
Yes, KEHONG BIO provides custom synthesis services for 尼罗蓝盐酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.