Benzoxazole, 2-(2-benzothiazolylmethyl)-
TL;DR: Benzoxazole, 2-(2-benzothiazolylmethyl)- (CAS 77854-59-2) is a chemical compound with molecular formula C15H10N2OS and molecular weight 266.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylmethyl)-1,3-benzoxazole
Also Known As: Benzoxazole, 2-(2-benzothiazolylmethyl)-, 2-(1,3-benzothiazol-2-ylmethyl)-1,3-benzoxazole, 2-(Benzothiazole-2-ylmethyl)benzoxazole, J1.829.485K, 2-[(1,3-benzothiazol-2-yl)methyl]-1,3-benzoxazole
| Molecular Formula | C15H10N2OS |
|---|---|
| Molecular Weight | 266.05 g/mol |
| LogP | 4.0283 |
| Topological Polar Surface Area | 38.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.0514 |
| Heavy Atoms | 19 |
| Complexity | 724.4841 |
Chemical Identifiers
| CAS Number | 77854-59-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)CC3=NC4=CC=CC=C4S3 |
Product Overview
Benzoxazole, 2-(2-benzothiazolylmethyl)- (CAS 77854-59-2), with molecular formula C15H10N2OS and molecular weight 266.05 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylmethyl)-1,3-benzoxazole.
Chemical Property Profile of Benzoxazole, 2-(2-benzothiazolylmethyl)-
Property Insights of Benzoxazole, 2-(2-benzothiazolylmethyl)-
The XLogP value of 4.0283 indicates that Benzoxazole, 2-(2-benzothiazolylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.92 Ų, Benzoxazole, 2-(2-benzothiazolylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoxazole, 2-(2-benzothiazolylmethyl)- 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 Benzoxazole, 2-(2-benzothiazolylmethyl)-?
The CAS number of Benzoxazole, 2-(2-benzothiazolylmethyl)- is 77854-59-2.
What is the molecular formula of Benzoxazole, 2-(2-benzothiazolylmethyl)-?
The molecular formula of Benzoxazole, 2-(2-benzothiazolylmethyl)- is C15H10N2OS.
What is the molecular weight of Benzoxazole, 2-(2-benzothiazolylmethyl)-?
The molecular weight of Benzoxazole, 2-(2-benzothiazolylmethyl)- is 266.05 g/mol.
Where can I buy Benzoxazole, 2-(2-benzothiazolylmethyl)-?
You can request a quote for Benzoxazole, 2-(2-benzothiazolylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoxazole, 2-(2-benzothiazolylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoxazole, 2-(2-benzothiazolylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.