Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide
TL;DR: Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide (CAS 66729-75-7) is a chemical compound with molecular formula C15H19ClN2O2S and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1,1-dioxo-N-(2-piperidin-1-ylethyl)-1-benzothiophen-3-amine
Also Known As: 4-Ethinylchinolin, BENZO(b)THIOPHENE, 2-CHLORO-3-(2-(4-PIPERIDYL)ETHYLAMINO)-, 1,1-DIOXIDE, 2-Chloro-3-(2-(4-piperidyl)ethylamino)benzo(b)thiophene 1,1-dioxide, 2-chloro-1,1-dioxo-N-(2-piperidin-1-ylethyl)-1-benzothiophen-3-amine, 1-Piperidineethanamine, N-(2-chloro-1,1-dioxidobenzo[b]thien-3-yl)-
| Molecular Formula | C15H19ClN2O2S |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.08557 |
| Heavy Atoms | 21 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 66729-75-7 |
|---|---|
| SMILES | C1CCN(CC1)CCNC2=C(S(=O)(=O)C3=CC=CC=C32)Cl |
| InChIKey | GJMCQOCRSNSQAB-UHFFFAOYSA-N |
Product Overview
Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide (CAS 66729-75-7), with molecular formula C15H19ClN2O2S and molecular weight 326.09 g/mol. IUPAC: 2-chloro-1,1-dioxo-N-(2-piperidin-1-ylethyl)-1-benzothiophen-3-amine.
Chemical Property Profile of Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide
Property Insights of Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide. With a topological polar surface area (TPSA) of 57.8 Ų, Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide has 1 hydrogen bond donor(s) and 4 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, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide?
The CAS number of Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide is 66729-75-7.
What is the molecular formula of Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide?
The molecular formula of Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide is C15H19ClN2O2S.
What is the molecular weight of Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide?
The molecular weight of Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide is 326.09 g/mol.
Where can I buy Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide?
You can request a quote for Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide 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, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)thiophene, 2-chloro-3-(2-(4-piperidyl)ethylamino)-, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.