1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-
TL;DR: 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- (CAS 77871-94-4) is a chemical compound with molecular formula C23H24FN3O and molecular weight 377.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-4-(8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl)butan-1-one
Also Known As: 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-, 1-(4-Fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)butan-1-one, BRN 4574578, RefChem:228869
| Molecular Formula | C23H24FN3O |
|---|---|
| Molecular Weight | 377.19 g/mol |
| LogP | 3.9699 |
| Topological Polar Surface Area | 39.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.19034 |
| Heavy Atoms | 28 |
| Complexity | 1010.36426 |
Chemical Identifiers
| CAS Number | 77871-94-4 |
|---|---|
| SMILES | C1C2CN(CN2CC3=C1C4=CC=CC=C4N3)CCCC(=O)C5=CC=C(C=C5)F |
Product Overview
1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- (CAS 77871-94-4), with molecular formula C23H24FN3O and molecular weight 377.19 g/mol. IUPAC: 1-(4-fluorophenyl)-4-(8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl)butan-1-one.
Chemical Property Profile of 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-
Property Insights of 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-
The XLogP value of 3.9699 indicates that 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.34 Ų, 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- 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 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-?
The CAS number of 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- is 77871-94-4.
What is the molecular formula of 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-?
The molecular formula of 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- is C23H24FN3O.
What is the molecular weight of 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-?
The molecular weight of 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- is 377.19 g/mol.
Where can I buy 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-?
You can request a quote for 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanone, 1-(4-fluorophenyl)-4-(5,6,11,11a-tetrahydro-1H-imidazo(1',5':1,6)pyrido(3,4-b)indol-2(3H)-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.