![N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine structure](/static/products/6165/61656-40-4.webp)
N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine
TL;DR: N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine (CAS 61656-40-4) is a chemical compound with molecular formula C17H13N3OS and molecular weight 307.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine
Also Known As: N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine, N-[(3-Phenylisoxazol-5-yl)methyl]-1,3-benzothiazol-2-amine, N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amin
| Molecular Formula | C17H13N3OS |
|---|---|
| Molecular Weight | 307.08 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.07794 |
| Heavy Atoms | 22 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 61656-40-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NOC(=C2)CNC3=NC4=CC=CC=C4S3 |
| InChIKey | ZNGJJFAFVNFTIZ-UHFFFAOYSA-N |
Product Overview
N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine (CAS 61656-40-4), with molecular formula C17H13N3OS and molecular weight 307.08 g/mol. IUPAC: N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine.
Chemical Property Profile of N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine
Property Insights of N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine
The XLogP value of 4.3 indicates that N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine. Following Lipinski's Rule of Five, N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine has 1 hydrogen bond donor(s) and 5 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 N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine?
The CAS number of N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine is 61656-40-4.
What is the molecular formula of N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine?
The molecular formula of N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine is C17H13N3OS.
What is the molecular weight of N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine?
The molecular weight of N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine is 307.08 g/mol.
Where can I buy N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine?
You can request a quote for N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1,3-benzothiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.