N-(bromoacetylamino)cyanopindolol
TL;DR: N-(bromoacetylamino)cyanopindolol (CAS 95034-01-8) is a chemical compound with molecular formula C18H23BrN4O3 and molecular weight 422.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[2-[[3-[(2-cyano-1H-indol-5-yl)oxy]-2-hydroxypropyl]amino]-2-methylpropyl]acetamide
Also Known As: Bam-cyp, N-(Bromoacetylamino)cyanopindolol, 2-bromo-N-[2-[[3-[(2-cyano-1H-indol-5-yl)oxy]-2-hydroxypropyl]amino]-2-methylpropyl]acetamide, 2-Cyano-4-(2-hydroxy-3-(2-bromoacetamido-1,1-dimethylethylamino)propoxy)indole, Acetamide, 2-bromo-N-(2-((3-((2-cyano-1H-indol-4-yl)oxy)-2-hydroxypropyl)amino)-2-methylpropyl)-, (2S-(2alpha,5alpha,6beta))-
| Molecular Formula | C18H23BrN4O3 |
|---|---|
| Molecular Weight | 422.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 422.09534 |
| Heavy Atoms | 26 |
| Complexity | 522.0 |
Chemical Identifiers
| CAS Number | 95034-01-8 |
|---|---|
| SMILES | CC(C)(CNC(=O)CBr)NCC(COC1=CC2=C(C=C1)NC(=C2)C#N)O |
| InChIKey | QKUSEJJABZAXFT-UHFFFAOYSA-N |
Product Overview
N-(bromoacetylamino)cyanopindolol (CAS 95034-01-8), with molecular formula C18H23BrN4O3 and molecular weight 422.10 g/mol. IUPAC: 2-bromo-N-[2-[[3-[(2-cyano-1H-indol-5-yl)oxy]-2-hydroxypropyl]amino]-2-methylpropyl]acetamide.
Chemical Property Profile of N-(bromoacetylamino)cyanopindolol
Property Insights of N-(bromoacetylamino)cyanopindolol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(bromoacetylamino)cyanopindolol. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(bromoacetylamino)cyanopindolol. Following Lipinski's Rule of Five, N-(bromoacetylamino)cyanopindolol has 4 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 N-(bromoacetylamino)cyanopindolol?
The CAS number of N-(bromoacetylamino)cyanopindolol is 95034-01-8.
What is the molecular formula of N-(bromoacetylamino)cyanopindolol?
The molecular formula of N-(bromoacetylamino)cyanopindolol is C18H23BrN4O3.
What is the molecular weight of N-(bromoacetylamino)cyanopindolol?
The molecular weight of N-(bromoacetylamino)cyanopindolol is 422.10 g/mol.
Where can I buy N-(bromoacetylamino)cyanopindolol?
You can request a quote for N-(bromoacetylamino)cyanopindolol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(bromoacetylamino)cyanopindolol?
Yes, KEHONG BIO provides custom synthesis services for N-(bromoacetylamino)cyanopindolol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.