BAS 00383942
TL;DR: BAS 00383942 (CAS 294854-16-3) is a chemical compound with molecular formula C23H28BrN7O3 and molecular weight 529.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(5-bromo-2-hydroxy-1H-indol-3-yl)diazenyl]-3-methyl-7-nonylpurine-2,6-dione
Also Known As: BAS 00383942, (E)-8-(2-(5-bromo-2-oxoindolin-3-ylidene)hydrazinyl)-3-methyl-7-nonyl-1H-purine-2,6(3H,7H)-dione, 8-[(2E)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione, 8-[2-(5-bromo-2-oxoindol-3-yl)hydrazinyl]-3-methyl-7-nonylpurine-2,6-dione, 8-[(2E)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-6-hydroxy-3-methyl-7-nonyl-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C23H28BrN7O3 |
|---|---|
| Molecular Weight | 529.14 g/mol |
| LogP | 5.5387 |
| Topological Polar Surface Area | 133.42 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 529.1437 |
| Heavy Atoms | 34 |
| Complexity | 1461.509 |
Chemical Identifiers
| CAS Number | 294854-16-3 |
|---|---|
| SMILES | CCCCCCCCCN1C2=C(N=C1N=NC3=C(NC4=C3C=C(C=C4)Br)O)N(C(=O)NC2=O)C |
Product Overview
BAS 00383942 (CAS 294854-16-3), with molecular formula C23H28BrN7O3 and molecular weight 529.14 g/mol. IUPAC: 8-[(5-bromo-2-hydroxy-1H-indol-3-yl)diazenyl]-3-methyl-7-nonylpurine-2,6-dione.
Chemical Property Profile of BAS 00383942
Property Insights of BAS 00383942
The XLogP value of 5.5387 indicates that BAS 00383942 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00383942. Following Lipinski's Rule of Five, BAS 00383942 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00383942?
The CAS number of BAS 00383942 is 294854-16-3.
What is the molecular formula of BAS 00383942?
The molecular formula of BAS 00383942 is C23H28BrN7O3.
What is the molecular weight of BAS 00383942?
The molecular weight of BAS 00383942 is 529.14 g/mol.
Where can I buy BAS 00383942?
You can request a quote for BAS 00383942 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00383942?
Yes, KEHONG BIO provides custom synthesis services for BAS 00383942 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.