Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-
TL;DR: Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- (CAS 128554-85-8) is a chemical compound with molecular formula C14H17N3O2S and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-N-(2-pyrrolidin-1-ylethyl)-1-benzothiophen-3-amine
Also Known As: Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-, 2-Nitro-N-(2-(1-pyrrolidinyl)ethyl)benzo(b)thiophen-3-amine, 2-nitro-N-(2-pyrrolidin-1-ylethyl)-1-benzothiophen-3-amine, 2-NITRO-N-[2-(PYRROLIDIN-1-YL)ETHYL]-1-BENZOTHIOPHEN-3-AMINE, BRN 3559199
| Molecular Formula | C14H17N3O2S |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | 3.3172 |
| Topological Polar Surface Area | 58.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.10416 |
| Heavy Atoms | 20 |
| Complexity | 619.90656 |
Chemical Identifiers
| CAS Number | 128554-85-8 |
|---|---|
| SMILES | C1CCN(C1)CCNC2=C(SC3=CC=CC=C32)[N+](=O)[O-] |
Product Overview
Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- (CAS 128554-85-8), with molecular formula C14H17N3O2S and molecular weight 291.10 g/mol. IUPAC: 2-nitro-N-(2-pyrrolidin-1-ylethyl)-1-benzothiophen-3-amine.
Chemical Property Profile of Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-
Property Insights of Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-
The XLogP value of 3.3172 indicates that Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.41 Ų, Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- has 1 hydrogen bond donor(s) and 5 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)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-?
The CAS number of Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- is 128554-85-8.
What is the molecular formula of Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-?
The molecular formula of Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- is C14H17N3O2S.
What is the molecular weight of Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-?
The molecular weight of Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- is 291.10 g/mol.
Where can I buy Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-?
You can request a quote for Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(b)thiophen-3-amine, 2-nitro-N-(2-(1-pyrrolidinyl)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.