N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine
TL;DR: N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine (CAS 16987-36-3) is a chemical compound with molecular formula C11H16N2S and molecular weight 208.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(azepan-1-yl)-1-thiophen-2-ylmethanimine
Also Known As: NCIOpen2_005618, Hexahydro-1-(2-thenylideneamino)azepine, Hexamethylenimine, 1-(2-thenylideneamino), N-(azepan-1-yl)-1-thiophen-2-ylmethanimine, 1H-Azepine, hexahydro-1-(2-thenylideneamino)-
| Molecular Formula | C11H16N2S |
|---|---|
| Molecular Weight | 208.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.10342 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 16987-36-3 |
|---|---|
| SMILES | C1CCCN(CC1)N=CC2=CC=CS2 |
| InChIKey | FRPQKUWSXLTFKR-UHFFFAOYSA-N |
Product Overview
N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine (CAS 16987-36-3), with molecular formula C11H16N2S and molecular weight 208.10 g/mol. IUPAC: N-(azepan-1-yl)-1-thiophen-2-ylmethanimine.
Chemical Property Profile of N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine
Property Insights of N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine
The XLogP value of 3.3 indicates that N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.8 Ų, N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine 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 N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine?
The CAS number of N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine is 16987-36-3.
What is the molecular formula of N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine?
The molecular formula of N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine is C11H16N2S.
What is the molecular weight of N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine?
The molecular weight of N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine is 208.10 g/mol.
Where can I buy N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine?
You can request a quote for N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine?
Yes, KEHONG BIO provides custom synthesis services for N-(Azepan-1-yl)-1-(thiophen-2-yl)methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.