Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride
TL;DR: Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride (CAS 335665-82-2) is a chemical compound with molecular formula C15H21ClFNO and molecular weight 285.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(azepan-1-yl)-1-(4-fluorophenyl)propan-1-one;hydrochloride
Also Known As: Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride, 4'-Fluoro-3-(1-hexamethyleneimino)propiophenone hydrochloride, 3-(azepan-1-yl)-1-(4-fluorophenyl)propan-1-one hydrochloride(1:1), 3-(azepan-1-yl)-1-(4-fluorophenyl)propan-1-one hydrochloride, 3-(azepan-1-yl)-1-(4-fluorophenyl)propan-1-one,hydrochloride
| Molecular Formula | C15H21ClFNO |
|---|---|
| Molecular Weight | 285.13 g/mol |
| LogP | 3.6963 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.12958 |
| Heavy Atoms | 19 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 335665-82-2 |
|---|---|
| SMILES | C1CCCN(CC1)CCC(=O)C2=CC=C(C=C2)F.Cl |
| InChIKey | RUYWWKZVSXKBAM-UHFFFAOYSA-N |
Product Overview
Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride (CAS 335665-82-2), with molecular formula C15H21ClFNO and molecular weight 285.13 g/mol. IUPAC: 3-(azepan-1-yl)-1-(4-fluorophenyl)propan-1-one;hydrochloride.
Chemical Property Profile of Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride
Property Insights of Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride
The XLogP value of 3.6963 indicates that Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride 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 Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride?
The CAS number of Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride is 335665-82-2.
What is the molecular formula of Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride?
The molecular formula of Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride is C15H21ClFNO.
What is the molecular weight of Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride?
The molecular weight of Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride is 285.13 g/mol.
Where can I buy Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride?
You can request a quote for Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.