RefChem:331434
TL;DR: RefChem:331434 (CAS 83892-96-0) is a chemical compound with molecular formula C24H28FN3O and molecular weight 393.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-4-[methyl-[2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)ethyl]amino]butan-1-one
Also Known As: Butyrophenone, 4'-fluoro-4-(methyl(2-(1,2,3,4-tetrahydro-9H-pyrido(3,4-b)indol-2-yl)ethyl)amino)-, 1-(4-FLUOROPHENYL)-4-[METHYL(2-{1H,2H,3H,4H,9H-PYRIDO[3,4-B]INDOL-2-YL}ETHYL)AMINO]BUTAN-1-ONE, 1-(4-fluorophenyl)-4-[methyl-[2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)ethyl]amino]butan-1-one, 1-(4-Fluorophenyl)-4-{methyl[2-(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethyl]amino}butan-1-one, 4 -Fluoro-gamma-[methyl[2-(1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indol-2-yl)ethyl]amino]butyrophenone
| Molecular Formula | C24H28FN3O |
|---|---|
| Molecular Weight | 393.22 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 39.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 393.22165 |
| Heavy Atoms | 29 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 83892-96-0 |
|---|---|
| SMILES | CN(CCCC(=O)C1=CC=C(C=C1)F)CCN2CCC3=C(C2)NC4=CC=CC=C34 |
| InChIKey | DCKUMCKLQBKGRY-UHFFFAOYSA-N |
Product Overview
RefChem:331434 (CAS 83892-96-0), with molecular formula C24H28FN3O and molecular weight 393.22 g/mol. IUPAC: 1-(4-fluorophenyl)-4-[methyl-[2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)ethyl]amino]butan-1-one.
Chemical Property Profile of RefChem:331434
Property Insights of RefChem:331434
The XLogP value of 3.8 indicates that RefChem:331434 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.3 Ų, RefChem:331434 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:331434 has 1 hydrogen bond donor(s) and 4 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 RefChem:331434?
The CAS number of RefChem:331434 is 83892-96-0.
What is the molecular formula of RefChem:331434?
The molecular formula of RefChem:331434 is C24H28FN3O.
What is the molecular weight of RefChem:331434?
The molecular weight of RefChem:331434 is 393.22 g/mol.
Where can I buy RefChem:331434?
You can request a quote for RefChem:331434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:331434?
Yes, KEHONG BIO provides custom synthesis services for RefChem:331434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.