(7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium
TL;DR: (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium (CAS 81029-05-2) is a chemical compound with molecular formula C17H21N4O+ and molecular weight 297.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7,9-diamino-6-methylphenoxazin-3-ylidene)-diethylazanium
Also Known As: Brilliant Cresyl Blue ALD, M118, 1,3-Diamino-7-(diethylamino)-4-methylphenoxazin-5-ium, (7,9-diamino-6-methylphenoxazin-3-ylidene)-diethylazanium, 1,3-diamino-7-(diethylamino)-4-methyl-5lambda4-phenoxazin-5-ylium
| Molecular Formula | C17H21N4O+ |
|---|---|
| Molecular Weight | 297.17 g/mol |
| LogP | 2.21742 |
| Topological Polar Surface Area | 81.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.17154 |
| Heavy Atoms | 22 |
| Complexity | 889.155 |
Chemical Identifiers
| CAS Number | 81029-05-2 |
|---|---|
| SMILES | CC[N+](=C1C=CC2=NC3=C(C=C(C(=C3OC2=C1)C)N)N)CC |
Product Overview
(7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium (CAS 81029-05-2), with molecular formula C17H21N4O+ and molecular weight 297.17 g/mol. IUPAC: (7,9-diamino-6-methylphenoxazin-3-ylidene)-diethylazanium.
Chemical Property Profile of (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium
Property Insights of (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium
The XLogP value of 2.21742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium. The TPSA of 81.08 Ų falls within the moderate polarity range, balancing permeability and solubility for (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium. Following Lipinski's Rule of Five, (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium has 2 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 (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium?
The CAS number of (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium is 81029-05-2.
What is the molecular formula of (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium?
The molecular formula of (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium is C17H21N4O+.
What is the molecular weight of (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium?
The molecular weight of (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium is 297.17 g/mol.
Where can I buy (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium?
You can request a quote for (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium?
Yes, KEHONG BIO provides custom synthesis services for (7,9-Diamino-6-methylphenoxazin-3-ylidene)-diethylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.