AB01302702-01
TL;DR: AB01302702-01 (CAS 903195-82-4) is a chemical compound with molecular formula C16H23N3O and molecular weight 273.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxyethylamino)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Also Known As: AB01302702-01, 3-(2-hydroxyethylamino)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile, 3-[(2-hydroxyethyl)amino]-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile, 3-((2-hydroxyethyl)amino)-1-isobutyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
| Molecular Formula | C16H23N3O |
|---|---|
| Molecular Weight | 273.18 g/mol |
| LogP | 2.43478 |
| Topological Polar Surface Area | 68.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.1841 |
| Heavy Atoms | 20 |
| Complexity | 517.4338 |
Chemical Identifiers
| CAS Number | 903195-82-4 |
|---|---|
| SMILES | CC(C)CC1=NC(=C(C2=C1CCCC2)C#N)NCCO |
Product Overview
AB01302702-01 (CAS 903195-82-4), with molecular formula C16H23N3O and molecular weight 273.18 g/mol. IUPAC: 3-(2-hydroxyethylamino)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile.
Chemical Property Profile of AB01302702-01
Property Insights of AB01302702-01
The XLogP value of 2.43478 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01302702-01. The TPSA of 68.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01302702-01. Following Lipinski's Rule of Five, AB01302702-01 has 2 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 AB01302702-01?
The CAS number of AB01302702-01 is 903195-82-4.
What is the molecular formula of AB01302702-01?
The molecular formula of AB01302702-01 is C16H23N3O.
What is the molecular weight of AB01302702-01?
The molecular weight of AB01302702-01 is 273.18 g/mol.
Where can I buy AB01302702-01?
You can request a quote for AB01302702-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01302702-01?
Yes, KEHONG BIO provides custom synthesis services for AB01302702-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.