2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole
TL;DR: 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole (CAS 300862-36-6) is a chemical compound with molecular formula C18H13NOS and molecular weight 291.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(naphthalen-1-ylmethylsulfanyl)-1,3-benzoxazole
Also Known As: TimTec1_000551, 2-(naphthylmethylthio)benzoxazole, BAS 00478249, 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole, 2-(1-naphthylmethylsulfanyl)-1,3-benzoxazole
| Molecular Formula | C18H13NOS |
|---|---|
| Molecular Weight | 291.07 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.07178 |
| Heavy Atoms | 21 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 300862-36-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2CSC3=NC4=CC=CC=C4O3 |
| InChIKey | LDGCSJYDINWTRT-UHFFFAOYSA-N |
Product Overview
2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole (CAS 300862-36-6), with molecular formula C18H13NOS and molecular weight 291.07 g/mol. IUPAC: 2-(naphthalen-1-ylmethylsulfanyl)-1,3-benzoxazole.
Chemical Property Profile of 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole
Property Insights of 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole
The XLogP value of 5.4 indicates that 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.3 Ų, 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole?
The CAS number of 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole is 300862-36-6.
What is the molecular formula of 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole?
The molecular formula of 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole is C18H13NOS.
What is the molecular weight of 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole?
The molecular weight of 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole is 291.07 g/mol.
Where can I buy 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole?
You can request a quote for 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(Naphthalen-1-ylmethylsulfanyl)-benzooxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.