N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide
TL;DR: N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide (CAS 735337-77-6) is a chemical compound with molecular formula C25H25N3OS and molecular weight 415.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(dibenzylamino)acetamide
Also Known As: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(dibenzylamino)acetamide, N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide, N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(dibenzylamino)acetamide
| Molecular Formula | C25H25N3OS |
|---|---|
| Molecular Weight | 415.17 g/mol |
| LogP | 5.13948 |
| Topological Polar Surface Area | 56.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.17184 |
| Heavy Atoms | 30 |
| Complexity | 996.00574 |
Chemical Identifiers
| CAS Number | 735337-77-6 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)CN(CC3=CC=CC=C3)CC4=CC=CC=C4)C#N |
Product Overview
N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide (CAS 735337-77-6), with molecular formula C25H25N3OS and molecular weight 415.17 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(dibenzylamino)acetamide.
Chemical Property Profile of N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide
Property Insights of N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide
The XLogP value of 5.13948 indicates that N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.13 Ų, N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide?
The CAS number of N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide is 735337-77-6.
What is the molecular formula of N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide?
The molecular formula of N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide is C25H25N3OS.
What is the molecular weight of N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide?
The molecular weight of N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide is 415.17 g/mol.
Where can I buy N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide?
You can request a quote for N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-2-(dibenzylamino)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.