![N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine structure](/static/products/374/374100-40-0.png)
N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine
TL;DR: N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine (CAS 374100-40-0) is a chemical compound with molecular formula C22H25N5OS and molecular weight 407.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[8-(furan-2-yl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl]-N',N'-dimethylpropane-1,3-diamine
Also Known As: N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine, N1-(5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)-N3,N3-dimethylpropane-1,3-diamine
| Molecular Formula | C22H25N5OS |
|---|---|
| Molecular Weight | 407.18 g/mol |
| LogP | 4.7419 |
| Topological Polar Surface Area | 67.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.17798 |
| Heavy Atoms | 29 |
| Complexity | 1149.3975 |
Chemical Identifiers
| CAS Number | 374100-40-0 |
|---|---|
| SMILES | CN(C)CCCNC1=NC=NC2=C1SC3=C2C4=C(CCCC4)C(=N3)C5=CC=CO5 |
Product Overview
N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine (CAS 374100-40-0), with molecular formula C22H25N5OS and molecular weight 407.18 g/mol. IUPAC: N-[8-(furan-2-yl)-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl]-N',N'-dimethylpropane-1,3-diamine.
Chemical Property Profile of N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine
Property Insights of N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine
The XLogP value of 4.7419 indicates that N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.08 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine. Following Lipinski's Rule of Five, N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine has 1 hydrogen bond donor(s) and 7 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 N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine?
The CAS number of N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine is 374100-40-0.
What is the molecular formula of N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine?
The molecular formula of N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine is C22H25N5OS.
What is the molecular weight of N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine?
The molecular weight of N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine is 407.18 g/mol.
Where can I buy N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine?
You can request a quote for N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine?
Yes, KEHONG BIO provides custom synthesis services for N'-[5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N,N-dimethylpropane-1,3-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.