(E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
TL;DR: (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one (CAS 848063-17-2) is a chemical compound with molecular formula C29H29ClN2O3 and molecular weight 488.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a-[(E)-2-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]ethenyl]-4,4,6-trimethyl-1,3-dihydroimidazo[1,2-a]indol-2-one
Also Known As: (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one, 3a-[(E)-2-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]ethenyl]-4,4,6-trimethyl-1,3-dihydroimidazo[1,2-a]indol-2-one, 9a-[(E)-2-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}ethenyl]-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
| Molecular Formula | C29H29ClN2O3 |
|---|---|
| Molecular Weight | 488.19 g/mol |
| LogP | 5.87312 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 488.18668 |
| Heavy Atoms | 35 |
| Complexity | 1333.2522 |
Chemical Identifiers
| CAS Number | 848063-17-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N3CC(=O)NC3(C2(C)C)/C=C/C4=CC(=C(C=C4)OCC5=CC(=CC=C5)Cl)OC |
Product Overview
(E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one (CAS 848063-17-2), with molecular formula C29H29ClN2O3 and molecular weight 488.19 g/mol. IUPAC: 3a-[(E)-2-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]ethenyl]-4,4,6-trimethyl-1,3-dihydroimidazo[1,2-a]indol-2-one.
Chemical Property Profile of (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Property Insights of (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
The XLogP value of 5.87312 indicates that (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one?
The CAS number of (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one is 848063-17-2.
What is the molecular formula of (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one?
The molecular formula of (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one is C29H29ClN2O3.
What is the molecular weight of (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one?
The molecular weight of (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one is 488.19 g/mol.
Where can I buy (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one?
You can request a quote for (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-9a-(4-((3-chlorobenzyl)oxy)-3-methoxystyryl)-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.