分散蓝5
TL;DR: 分散蓝5 (CAS 4486-13-9) is a chemical compound with molecular formula C16H13N3O3 and molecular weight 295.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
分散蓝5
1-amino-4-(methylamino)-9,10-dioxoanthracene-2-carboxamide
Also Known As: C.I.Disperse Blue 5, Celliton Fast Blue FFB, 1-Amino-9,10-dihydro-4-(methylamino)-9,10-dioxoanthracene-2-carboxamide, 1-amino-4-(methylamino)-9,10-dioxoanthracene-2-carboxamide, 1-amino-4-(methylamino)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
| Molecular Formula | C16H13N3O3 |
|---|---|
| Molecular Weight | 295.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.0957 |
| Heavy Atoms | 22 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 4486-13-9 |
|---|---|
| SMILES | CNC1=C2C(=C(C(=C1)C(=O)N)N)C(=O)C3=CC=CC=C3C2=O |
| InChIKey | VJMCKXPFVWESHW-UHFFFAOYSA-N |
Product Overview
分散蓝5 (CAS 4486-13-9), with molecular formula C16H13N3O3 and molecular weight 295.10 g/mol. IUPAC: 1-amino-4-(methylamino)-9,10-dioxoanthracene-2-carboxamide.
Chemical Property Profile of 分散蓝5
Property Insights of 分散蓝5
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 分散蓝5. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 分散蓝5. Following Lipinski's Rule of Five, 分散蓝5 has 3 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 分散蓝5?
The CAS number of 分散蓝5 is 4486-13-9.
What is the molecular formula of 分散蓝5?
The molecular formula of 分散蓝5 is C16H13N3O3.
What is the molecular weight of 分散蓝5?
The molecular weight of 分散蓝5 is 295.10 g/mol.
Where can I buy 分散蓝5?
You can request a quote for 分散蓝5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 分散蓝5?
Yes, KEHONG BIO provides custom synthesis services for 分散蓝5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.