![[1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone structure](/static/products/3142/314282-98-9.webp)
[1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone
TL;DR: [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone (CAS 314282-98-9) is a chemical compound with molecular formula C19H21NO and molecular weight 279.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azepan-1-yl-(4-phenylphenyl)methanone
Also Known As: 1-(4-biphenylylcarbonyl)azepane, Azepan-1-yl-biphenyl-4-yl-methanone, azaperhydroepinyl 4-phenylphenyl ketone, azepan-1-yl-(4-phenylphenyl)methanone, BAS 00339898
| Molecular Formula | C19H21NO |
|---|---|
| Molecular Weight | 279.16 g/mol |
| LogP | 4.3698 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.16232 |
| Heavy Atoms | 21 |
| Complexity | 580.7232 |
Chemical Identifiers
| CAS Number | 314282-98-9 |
|---|---|
| SMILES | C1CCCN(CC1)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3 |
Product Overview
[1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone (CAS 314282-98-9), with molecular formula C19H21NO and molecular weight 279.16 g/mol. IUPAC: azepan-1-yl-(4-phenylphenyl)methanone.
Chemical Property Profile of [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone
Property Insights of [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone
The XLogP value of 4.3698 indicates that [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone has 0 hydrogen bond donor(s) and 1 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 [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone?
The CAS number of [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone is 314282-98-9.
What is the molecular formula of [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone?
The molecular formula of [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone is C19H21NO.
What is the molecular weight of [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone?
The molecular weight of [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone is 279.16 g/mol.
Where can I buy [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone?
You can request a quote for [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [1,1'-Biphenyl]-4-yl(hexahydro-1H-azepin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.