AB01280327-01
TL;DR: AB01280327-01 (CAS 330819-56-2) is a chemical compound with molecular formula C17H23N3OS and molecular weight 317.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-morpholin-4-yl-3-propan-2-ylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Also Known As: AB01280327-01, 1-(morpholin-4-yl)-3-(propan-2-ylsulfanyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile, 1-morpholin-4-yl-3-propan-2-ylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile, 3-(isopropylsulfanyl)-1-(4-morpholinyl)-5,6,7,8-tetrahydro-4-isoquinolinecarbonitrile, 3-(isopropylthio)-1-morpholino-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
| Molecular Formula | C17H23N3OS |
|---|---|
| Molecular Weight | 317.16 g/mol |
| LogP | 3.16918 |
| Topological Polar Surface Area | 49.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.1562 |
| Heavy Atoms | 22 |
| Complexity | 588.54736 |
Chemical Identifiers
| CAS Number | 330819-56-2 |
|---|---|
| SMILES | CC(C)SC1=C(C2=C(CCCC2)C(=N1)N3CCOCC3)C#N |
Product Overview
AB01280327-01 (CAS 330819-56-2), with molecular formula C17H23N3OS and molecular weight 317.16 g/mol. IUPAC: 1-morpholin-4-yl-3-propan-2-ylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile.
Chemical Property Profile of AB01280327-01
Property Insights of AB01280327-01
The XLogP value of 3.16918 indicates that AB01280327-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.15 Ų, AB01280327-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01280327-01 has 0 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 AB01280327-01?
The CAS number of AB01280327-01 is 330819-56-2.
What is the molecular formula of AB01280327-01?
The molecular formula of AB01280327-01 is C17H23N3OS.
What is the molecular weight of AB01280327-01?
The molecular weight of AB01280327-01 is 317.16 g/mol.
Where can I buy AB01280327-01?
You can request a quote for AB01280327-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01280327-01?
Yes, KEHONG BIO provides custom synthesis services for AB01280327-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.