1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one
TL;DR: 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one (CAS 6235-85-4) is a chemical compound with molecular formula C33H29N3O3S and molecular weight 547.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethanone
Also Known As: 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one, 1-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethanone, 1-[3,5-bis(4-methoxyphenyl)-4,5-dihydropyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethanone
| Molecular Formula | C33H29N3O3S |
|---|---|
| Molecular Weight | 547.19 g/mol |
| LogP | 7.3221 |
| Topological Polar Surface Area | 66.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 547.193 |
| Heavy Atoms | 40 |
| Complexity | 1661.609 |
Chemical Identifiers
| CAS Number | 6235-85-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C6=CC=C(C=C6)OC |
Product Overview
1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one (CAS 6235-85-4), with molecular formula C33H29N3O3S and molecular weight 547.19 g/mol. IUPAC: 1-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethanone.
Chemical Property Profile of 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one
Property Insights of 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one
The XLogP value of 7.3221 indicates that 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one. Following Lipinski's Rule of Five, 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one?
The CAS number of 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one is 6235-85-4.
What is the molecular formula of 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one?
The molecular formula of 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one is C33H29N3O3S.
What is the molecular weight of 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one?
The molecular weight of 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one is 547.19 g/mol.
Where can I buy 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one?
You can request a quote for 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.