N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
TL;DR: N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine (CAS 34608-45-2) is a chemical compound with molecular formula C12H17N3 and molecular weight 203.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
Also Known As: N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine, N-[2-AZEPANYLIDENE](4-PYRIDINYL)METHANAMINE, 4-pyridylmethyl(3,4,5,6-tetrahydro-2H-azepin-7-yl)amine
| Molecular Formula | C12H17N3 |
|---|---|
| Molecular Weight | 203.14 g/mol |
| LogP | 2.1437 |
| Topological Polar Surface Area | 37.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.14224 |
| Heavy Atoms | 15 |
| Complexity | 318.89893 |
Chemical Identifiers
| CAS Number | 34608-45-2 |
|---|---|
| SMILES | C1CCC(=NCC1)NCC2=CC=NC=C2 |
Product Overview
N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine (CAS 34608-45-2), with molecular formula C12H17N3 and molecular weight 203.14 g/mol. IUPAC: N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine.
Chemical Property Profile of N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
Property Insights of N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
The XLogP value of 2.1437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine. With a topological polar surface area (TPSA) of 37.28 Ų, N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine has 1 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-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
The CAS number of N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine is 34608-45-2.
What is the molecular formula of N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
The molecular formula of N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine is C12H17N3.
What is the molecular weight of N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
The molecular weight of N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine is 203.14 g/mol.
Where can I buy N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
You can request a quote for N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(pyridin-4-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.