9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-
TL;DR: 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro- (CAS 68516-55-2) is a chemical compound with molecular formula C14H8BrN3O4 and molecular weight 360.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-diamino-2-bromo-5-nitroanthracene-9,10-dione
Also Known As: EINECS 271-160-9, 1,4-Diamino-2-bromo-5-nitroanthraquinone, 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-, 1,4-diamino-2-bromo-5-nitroanthracene-9,10-dione, 1,4-Diamino-2-bromo-5-nitro-9,10-anthracenedione
| Molecular Formula | C14H8BrN3O4 |
|---|---|
| Molecular Weight | 360.97 g/mol |
| LogP | 2.2971 |
| Topological Polar Surface Area | 129.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 360.96982 |
| Heavy Atoms | 22 |
| Complexity | 892.1421 |
Chemical Identifiers
| CAS Number | 68516-55-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C2=O)C(=C(C=C3N)Br)N |
Product Overview
9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro- (CAS 68516-55-2), with molecular formula C14H8BrN3O4 and molecular weight 360.97 g/mol. IUPAC: 1,4-diamino-2-bromo-5-nitroanthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-
Property Insights of 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-
The XLogP value of 2.2971 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-. The TPSA of 129.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro- has 2 hydrogen bond donor(s) and 6 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 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-?
The CAS number of 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro- is 68516-55-2.
What is the molecular formula of 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-?
The molecular formula of 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro- is C14H8BrN3O4.
What is the molecular weight of 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-?
The molecular weight of 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro- is 360.97 g/mol.
Where can I buy 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-?
You can request a quote for 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1,4-diamino-2-bromo-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.