AB00684366-01
TL;DR: AB00684366-01 (CAS 476355-81-4) is a chemical compound with molecular formula C24H20N4O2S3 and molecular weight 492.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N,5-N-bis(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiophene-2,5-dicarboxamide
Also Known As: AB00684366-01, F0496-0065, N2,N5-bis(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiophene-2,5-dicarboxamide, N2,N5-bis(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)thiophene-2,5-dicarboxamide, 2-N,5-N-bis(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiophene-2,5-dicarboxamide
| Molecular Formula | C24H20N4O2S3 |
|---|---|
| Molecular Weight | 492.07 g/mol |
| LogP | 5.87666 |
| Topological Polar Surface Area | 105.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 492.07483 |
| Heavy Atoms | 33 |
| Complexity | 1248.3452 |
Chemical Identifiers
| CAS Number | 476355-81-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(S3)C(=O)NC4=C(C5=C(S4)CCCC5)C#N)C#N |
Product Overview
AB00684366-01 (CAS 476355-81-4), with molecular formula C24H20N4O2S3 and molecular weight 492.07 g/mol. IUPAC: 2-N,5-N-bis(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiophene-2,5-dicarboxamide.
Chemical Property Profile of AB00684366-01
Property Insights of AB00684366-01
The XLogP value of 5.87666 indicates that AB00684366-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.78 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684366-01. Following Lipinski's Rule of Five, AB00684366-01 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00684366-01?
The CAS number of AB00684366-01 is 476355-81-4.
What is the molecular formula of AB00684366-01?
The molecular formula of AB00684366-01 is C24H20N4O2S3.
What is the molecular weight of AB00684366-01?
The molecular weight of AB00684366-01 is 492.07 g/mol.
Where can I buy AB00684366-01?
You can request a quote for AB00684366-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684366-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684366-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.