AB01311150-01
TL;DR: AB01311150-01 (CAS 905015-49-8) is a chemical compound with molecular formula C16H22N4 and molecular weight 270.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Also Known As: AB01311150-01, 1-methyl-3-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
| Molecular Formula | C16H22N4 |
|---|---|
| Molecular Weight | 270.18 g/mol |
| LogP | 1.8923 |
| Topological Polar Surface Area | 43.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 270.18445 |
| Heavy Atoms | 20 |
| Complexity | 550.5758 |
Chemical Identifiers
| CAS Number | 905015-49-8 |
|---|---|
| SMILES | CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C)C#N |
Product Overview
AB01311150-01 (CAS 905015-49-8), with molecular formula C16H22N4 and molecular weight 270.18 g/mol. IUPAC: 1-methyl-3-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile.
Chemical Property Profile of AB01311150-01
Property Insights of AB01311150-01
The XLogP value of 1.8923 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01311150-01. With a topological polar surface area (TPSA) of 43.16 Ų, AB01311150-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01311150-01 has 0 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 AB01311150-01?
The CAS number of AB01311150-01 is 905015-49-8.
What is the molecular formula of AB01311150-01?
The molecular formula of AB01311150-01 is C16H22N4.
What is the molecular weight of AB01311150-01?
The molecular weight of AB01311150-01 is 270.18 g/mol.
Where can I buy AB01311150-01?
You can request a quote for AB01311150-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01311150-01?
Yes, KEHONG BIO provides custom synthesis services for AB01311150-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.