![(5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone structure](/static/products/660/660860-39-9.png)
(5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone
TL;DR: (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone (CAS 660860-39-9) is a chemical compound with molecular formula C12H15BrN2OS and molecular weight 314.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-bromothiophen-2-yl)-(1,4-diazabicyclo[3.2.2]nonan-4-yl)methanone
Also Known As: 1,4-diazabicyclo[3.2.2]nonan-4-yl(5-bromothiophen-2-yl)methanone, (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone, (5-bromothiophen-2-yl)-(1,4-diazabicyclo[3.2.2]non-4-yl)methanone
| Molecular Formula | C12H15BrN2OS |
|---|---|
| Molecular Weight | 314.01 g/mol |
| LogP | 2.4308 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.00885 |
| Heavy Atoms | 17 |
| Complexity | 425.89505 |
Chemical Identifiers
| CAS Number | 660860-39-9 |
|---|---|
| SMILES | C1CN2CCC1N(CC2)C(=O)C3=CC=C(S3)Br |
Product Overview
(5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone (CAS 660860-39-9), with molecular formula C12H15BrN2OS and molecular weight 314.01 g/mol. IUPAC: (5-bromothiophen-2-yl)-(1,4-diazabicyclo[3.2.2]nonan-4-yl)methanone.
Chemical Property Profile of (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone
Property Insights of (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone
The XLogP value of 2.4308 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone. With a topological polar surface area (TPSA) of 23.55 Ų, (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone has 0 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 (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone?
The CAS number of (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone is 660860-39-9.
What is the molecular formula of (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone?
The molecular formula of (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone is C12H15BrN2OS.
What is the molecular weight of (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone?
The molecular weight of (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone is 314.01 g/mol.
Where can I buy (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone?
You can request a quote for (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone?
Yes, KEHONG BIO provides custom synthesis services for (5-Bromo-thiophen-2-yl)-(1,4-diaza-bicyclo[3.2.2]non-4-yl)-methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.