N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
TL;DR: N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine (CAS 372086-89-0) is a chemical compound with molecular formula C20H26N4S and molecular weight 354.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-hexyl-8-methyl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-amine
Also Known As: N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine, N-HEXYL-N-(5-METHYL-1,2,3,4-TETRAHYDROPYRIMIDO[4',5':4,5]THIENO[2,3-C]ISOQUINOLIN-8-YL)AMINE
| Molecular Formula | C20H26N4S |
|---|---|
| Molecular Weight | 354.19 g/mol |
| LogP | 5.41892 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.1878 |
| Heavy Atoms | 25 |
| Complexity | 899.7241 |
Chemical Identifiers
| CAS Number | 372086-89-0 |
|---|---|
| SMILES | CCCCCCNC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)C |
Product Overview
N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine (CAS 372086-89-0), with molecular formula C20H26N4S and molecular weight 354.19 g/mol. IUPAC: N-hexyl-8-methyl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-amine.
Chemical Property Profile of N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Property Insights of N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
The XLogP value of 5.41892 indicates that N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.7 Ų, N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine?
The CAS number of N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine is 372086-89-0.
What is the molecular formula of N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine?
The molecular formula of N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine is C20H26N4S.
What is the molecular weight of N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine?
The molecular weight of N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine is 354.19 g/mol.
Where can I buy N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine?
You can request a quote for N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine?
Yes, KEHONG BIO provides custom synthesis services for N-hexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.