![3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone structure](/static/products/6629/6629-47-6.webp)
3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone
TL;DR: 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone (CAS 6629-47-6) is a chemical compound with molecular formula C17H17ClO3S and molecular weight 336.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)sulfanyl-1-(3,4-dimethoxyphenyl)propan-1-one
Also Known As: 3-[(4-chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone, 3-[(4-chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)propan-1-one, 3-(4-chlorophenyl)sulfanyl-1-(3,4-dimethoxyphenyl)propan-1-one
| Molecular Formula | C17H17ClO3S |
|---|---|
| Molecular Weight | 336.06 g/mol |
| LogP | 4.7223 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 336.0587 |
| Heavy Atoms | 22 |
| Complexity | 640.85236 |
Chemical Identifiers
| CAS Number | 6629-47-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)CCSC2=CC=C(C=C2)Cl)OC |
Product Overview
3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone (CAS 6629-47-6), with molecular formula C17H17ClO3S and molecular weight 336.06 g/mol. IUPAC: 3-(4-chlorophenyl)sulfanyl-1-(3,4-dimethoxyphenyl)propan-1-one.
Chemical Property Profile of 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone
Property Insights of 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone
The XLogP value of 4.7223 indicates that 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone has 0 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 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone?
The CAS number of 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone is 6629-47-6.
What is the molecular formula of 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone?
The molecular formula of 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone is C17H17ClO3S.
What is the molecular weight of 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone?
The molecular weight of 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone is 336.06 g/mol.
Where can I buy 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone?
You can request a quote for 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Chlorophenyl)sulfanyl]-1-(3,4-dimethoxyphenyl)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.