![3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide structure](/static/products/845/845987-91-9.png)
3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide
TL;DR: 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide (CAS 845987-91-9) is a chemical compound with molecular formula C20H20Cl2N2OS and molecular weight 406.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]-1-benzothiophene-2-carboxamide
Also Known As: 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]-1-benzothiophene-2-carboxamide, 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide, 3,6-Dichloro-benzo[b]thiophene-2-carboxylic acid (4-diethylaminomethyl-phenyl)-amide, 3,6-bis(chloranyl)-N-[4-(diethylaminomethyl)phenyl]-1-benzothiophene-2-carboxamide, 3,6-dichloro-N-(4-((diethylamino)methyl)phenyl)benzo[b]thiophene-2-carboxamide
| Molecular Formula | C20H20Cl2N2OS |
|---|---|
| Molecular Weight | 406.07 g/mol |
| LogP | 6.3022 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.06735 |
| Heavy Atoms | 26 |
| Complexity | 917.45593 |
Chemical Identifiers
| CAS Number | 845987-91-9 |
|---|---|
| SMILES | CCN(CC)CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl |
Product Overview
3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide (CAS 845987-91-9), with molecular formula C20H20Cl2N2OS and molecular weight 406.07 g/mol. IUPAC: 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide
Property Insights of 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide
The XLogP value of 6.3022 indicates that 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide?
The CAS number of 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide is 845987-91-9.
What is the molecular formula of 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide?
The molecular formula of 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide is C20H20Cl2N2OS.
What is the molecular weight of 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide?
The molecular weight of 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide is 406.07 g/mol.
Where can I buy 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide?
You can request a quote for 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,6-dichloro-N-[4-(diethylaminomethyl)phenyl]benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.