CTK4B5064
TL;DR: CTK4B5064 (CAS 126233-98-5) is a chemical compound with molecular formula C15H19N3O and molecular weight 257.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-but-2-enyl-11-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one
Also Known As: (+-)-(Z)-6-(2-Buten-1-yl)-4,5,6,7-tetrahydro-5-methylimidazo(4,5,1-jk)(1,4)benzodiazepin-2(1H)-one, (+-)-6-(E-2-Buten-1-yl)-4,5,6,7-tetrahydro-5-methylimidazo(4,5,1-jk)(1,4)benzodiazepin-2(1H)-one, (Z)-6-(2-BUTEN-1-YL)-4,5,6,7-TETRAHYDRO-5-METHYLIMIDAZO[4,5,1-JK][1,4]BENZODIAZEPIN-2(1H)-ONE, 6-(E-2-Buten-1-yl)-4,5,6,7-tetrahydro-5-methylimidazo[4,5,1-jk][1,4]benzodiazepin-2(1H)-one
| Molecular Formula | C15H19N3O |
|---|---|
| Molecular Weight | 257.15 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.1528 |
| Heavy Atoms | 19 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 126233-98-5 |
|---|---|
| SMILES | CC=CCN1CC2=C3C(=CC=C2)NC(=O)N3CC1C |
| InChIKey | BXSCALBOIWKKQO-UHFFFAOYSA-N |
Product Overview
CTK4B5064 (CAS 126233-98-5), with molecular formula C15H19N3O and molecular weight 257.15 g/mol. IUPAC: 10-but-2-enyl-11-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one.
Chemical Property Profile of CTK4B5064
Property Insights of CTK4B5064
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK4B5064. With a topological polar surface area (TPSA) of 35.6 Ų, CTK4B5064 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK4B5064 has 1 hydrogen bond donor(s) and 2 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 CTK4B5064?
The CAS number of CTK4B5064 is 126233-98-5.
What is the molecular formula of CTK4B5064?
The molecular formula of CTK4B5064 is C15H19N3O.
What is the molecular weight of CTK4B5064?
The molecular weight of CTK4B5064 is 257.15 g/mol.
Where can I buy CTK4B5064?
You can request a quote for CTK4B5064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4B5064?
Yes, KEHONG BIO provides custom synthesis services for CTK4B5064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.