3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
TL;DR: 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile (CAS 371937-48-3) is a chemical compound with molecular formula C17H24N4 and molecular weight 284.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-piperazin-1-yl-1-propan-2-yl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Also Known As: 3-piperazin-1-yl-1-propan-2-yl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile, 1-ISOPROPYL-3-(PIPERAZIN-1-YL)-5,6,7,8-TETRAHYDROISOQUINOLINE-4-CARBONITRILE, 3-(piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
| Molecular Formula | C17H24N4 |
|---|---|
| Molecular Weight | 284.20 g/mol |
| LogP | 2.36508 |
| Topological Polar Surface Area | 51.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.2001 |
| Heavy Atoms | 21 |
| Complexity | 565.13336 |
Chemical Identifiers
| CAS Number | 371937-48-3 |
|---|---|
| SMILES | CC(C)C1=NC(=C(C2=C1CCCC2)C#N)N3CCNCC3 |
Product Overview
3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile (CAS 371937-48-3), with molecular formula C17H24N4 and molecular weight 284.20 g/mol. IUPAC: 3-piperazin-1-yl-1-propan-2-yl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile.
Chemical Property Profile of 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Property Insights of 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
The XLogP value of 2.36508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile. With a topological polar surface area (TPSA) of 51.95 Ų, 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile has 1 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 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
The CAS number of 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile is 371937-48-3.
What is the molecular formula of 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
The molecular formula of 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile is C17H24N4.
What is the molecular weight of 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
The molecular weight of 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile is 284.20 g/mol.
Where can I buy 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
You can request a quote for 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(Piperazin-1-yl)-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.