N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide
TL;DR: N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide (CAS 600122-27-8) is a chemical compound with molecular formula C15H18ClNOS and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide
Also Known As: N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide, benzo[b]thiophene-2-carboxamide,N-butyl-3-chloro-N-ethyl-, N-butyl-3-chloro-N-ethyl-benzothiophene-2-carboxamide, N-butyl(3-chlorobenzo[b]thiophen-2-yl)-N-ethylcarboxamide, Benzo[b]thiophene-2-carboxamide, N-butyl-3-chloro-N-ethyl- (9CI)
| Molecular Formula | C15H18ClNOS |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | 4.8169 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.07977 |
| Heavy Atoms | 19 |
| Complexity | 578.5293 |
Chemical Identifiers
| CAS Number | 600122-27-8 |
|---|---|
| SMILES | CCCCN(CC)C(=O)C1=C(C2=CC=CC=C2S1)Cl |
Product Overview
N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide (CAS 600122-27-8), with molecular formula C15H18ClNOS and molecular weight 295.08 g/mol. IUPAC: N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide.
Chemical Property Profile of N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide
Property Insights of N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide
The XLogP value of 4.8169 indicates that N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide has 0 hydrogen bond donor(s) and 2 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-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide?
The CAS number of N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide is 600122-27-8.
What is the molecular formula of N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide?
The molecular formula of N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide is C15H18ClNOS.
What is the molecular weight of N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide?
The molecular weight of N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide is 295.08 g/mol.
Where can I buy N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide?
You can request a quote for N-butyl-3-chloro-N-ethyl-1-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 N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-3-chloro-N-ethyl-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.