1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone
TL;DR: 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone (CAS 298686-13-2) is a chemical compound with molecular formula C21H18N4O2S and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone
Also Known As: 1-[4-methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone, 1-[4-methoxy-3-({[1-(1-naphthyl)-1H-tetraazol-5-yl]thio}methyl)phenyl]ethanone, 1-[4-methoxy-3-({[1-(naphthalen-1-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)phenyl]ethanone
| Molecular Formula | C21H18N4O2S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 4.319 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.11505 |
| Heavy Atoms | 28 |
| Complexity | 1150.8268 |
Chemical Identifiers
| CAS Number | 298686-13-2 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=NN2C3=CC=CC4=CC=CC=C43 |
Product Overview
1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone (CAS 298686-13-2), with molecular formula C21H18N4O2S and molecular weight 390.12 g/mol. IUPAC: 1-[4-methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone.
Chemical Property Profile of 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone
Property Insights of 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone
The XLogP value of 4.319 indicates that 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone. Following Lipinski's Rule of Five, 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone has 0 hydrogen bond donor(s) and 6 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-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone?
The CAS number of 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone is 298686-13-2.
What is the molecular formula of 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone?
The molecular formula of 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone is C21H18N4O2S.
What is the molecular weight of 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone?
The molecular weight of 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone is 390.12 g/mol.
Where can I buy 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone?
You can request a quote for 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-Methoxy-3-[(1-naphthalen-1-yltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.