Bisindolylmaleimide IX
TL;DR: Bisindolylmaleimide IX (CAS 125314-64-9) is a chemical compound with molecular formula C25H23N5O2S and molecular weight 457.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-[4-(1-methylindol-3-yl)-2,5-dioxopyrrol-3-yl]indol-1-yl]propyl carbamimidothioate
Also Known As: bisindolylmaleimide IX, ro 31-8220, Bis IX, bisindolymaleimide IX, Ro31-8220
| Molecular Formula | C25H23N5O2S |
|---|---|
| Molecular Weight | 457.16 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.15726 |
| Heavy Atoms | 33 |
| Complexity | 845.0 |
Chemical Identifiers
| CAS Number | 125314-64-9 |
|---|---|
| SMILES | CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)CCCSC(=N)N |
| InChIKey | DSXXEELGXBCYNQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bisindolylmaleimide IX (CAS 125314-64-9), with molecular formula C25H23N5O2S and molecular weight 457.16 g/mol. IUPAC: 3-[3-[4-(1-methylindol-3-yl)-2,5-dioxopyrrol-3-yl]indol-1-yl]propyl carbamimidothioate.
Chemical Property Profile of Bisindolylmaleimide IX
Property Insights of Bisindolylmaleimide IX
The XLogP value of 3.0 indicates that Bisindolylmaleimide IX is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bisindolylmaleimide IX. Following Lipinski's Rule of Five, Bisindolylmaleimide IX has 3 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 Bisindolylmaleimide IX?
The CAS number of Bisindolylmaleimide IX is 125314-64-9.
What is the molecular formula of Bisindolylmaleimide IX?
The molecular formula of Bisindolylmaleimide IX is C25H23N5O2S.
What is the molecular weight of Bisindolylmaleimide IX?
The molecular weight of Bisindolylmaleimide IX is 457.16 g/mol.
Where can I buy Bisindolylmaleimide IX?
You can request a quote for Bisindolylmaleimide IX directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bisindolylmaleimide IX?
Yes, KEHONG BIO provides custom synthesis services for Bisindolylmaleimide IX and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.