1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone
TL;DR: 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone (CAS 400080-97-9) is a chemical compound with molecular formula C19H16O3S2 and molecular weight 356.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonyl)-3-naphthalen-2-ylsulfanylpropan-2-one
Also Known As: 1-(2-naphthylsulfanyl)-3-(phenylsulfonyl)acetone, 3H-447S, 1-(benzenesulfonyl)-3-naphthalen-2-ylsulfanylpropan-2-one, 1-(benzenesulfonyl)-3-(naphthalen-2-ylsulfanyl)propan-2-one
| Molecular Formula | C19H16O3S2 |
|---|---|
| Molecular Weight | 356.05 g/mol |
| LogP | 3.9749 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.05408 |
| Heavy Atoms | 24 |
| Complexity | 964.0832 |
Chemical Identifiers
| CAS Number | 400080-97-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)CC(=O)CSC2=CC3=CC=CC=C3C=C2 |
Product Overview
1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone (CAS 400080-97-9), with molecular formula C19H16O3S2 and molecular weight 356.05 g/mol. IUPAC: 1-(benzenesulfonyl)-3-naphthalen-2-ylsulfanylpropan-2-one.
Chemical Property Profile of 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone
Property Insights of 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone
The XLogP value of 3.9749 indicates that 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.21 Ų, 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone 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 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone?
The CAS number of 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone is 400080-97-9.
What is the molecular formula of 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone?
The molecular formula of 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone is C19H16O3S2.
What is the molecular weight of 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone?
The molecular weight of 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone is 356.05 g/mol.
Where can I buy 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone?
You can request a quote for 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Naphthylsulfanyl)-3-(phenylsulfonyl)acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.