Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride
TL;DR: Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride (CAS 85180-00-3) is a chemical compound with molecular formula C15H21ClN2OS and molecular weight 312.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzothiophene-3-carbonylamino)ethyl-diethylazanium chloride
Also Known As: N-(2-(Diethylamino)ethyl)benzo(b)thiophene-3-carboxamide hydrochloride, BENZO(b)THIOPHENE-3-CARBOXAMIDE, N-(2-(DIETHYLAMINO)ETHYL)-, MONOHYDROCHLORIDE, 2-(1-benzothiophene-3-carbonylamino)ethyl-diethylazanium chloride, RefChem:326222
| Molecular Formula | C15H21ClN2OS |
|---|---|
| Molecular Weight | 312.11 g/mol |
| LogP | -1.44 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.10632 |
| Heavy Atoms | 20 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 85180-00-3 |
|---|---|
| SMILES | CC[NH+](CC)CCNC(=O)C1=CSC2=CC=CC=C21.[Cl-] |
| InChIKey | LZFOPLLYYOUBKA-UHFFFAOYSA-N |
Product Overview
Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride (CAS 85180-00-3), with molecular formula C15H21ClN2OS and molecular weight 312.11 g/mol. IUPAC: 2-(1-benzothiophene-3-carbonylamino)ethyl-diethylazanium chloride.
Chemical Property Profile of Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride
Property Insights of Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride
The XLogP value of -1.44 indicates that Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride. Following Lipinski's Rule of Five, Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride has 2 hydrogen bond donor(s) and 3 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 Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride?
The CAS number of Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride is 85180-00-3.
What is the molecular formula of Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride?
The molecular formula of Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride is C15H21ClN2OS.
What is the molecular weight of Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride?
The molecular weight of Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride is 312.11 g/mol.
Where can I buy Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride?
You can request a quote for Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)thiophene-3-carboxamide, N-(2-(diethylamino)ethyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.