![2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide structure](/static/products/876/876717-40-7.png)
2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide
TL;DR: 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide (CAS 876717-40-7) is a chemical compound with molecular formula C17H15N3O3S and molecular weight 341.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(1,3-benzoxazol-2-ylsulfanyl)propanoylamino]benzamide
Also Known As: BAS 09869117, 2-{[2-(1,3-benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide, 2-(2-benzoxazol-2-ylthiopropanoylamino)benzamide, 2-[2-(1,3-benzoxazol-2-ylsulfanyl)propanoylamino]benzamide, 2-[2-(Benzooxazol-2-ylsulfanyl)-propionylamino]-benzamide
| Molecular Formula | C17H15N3O3S |
|---|---|
| Molecular Weight | 341.08 g/mol |
| LogP | 3.046 |
| Topological Polar Surface Area | 98.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.0834 |
| Heavy Atoms | 24 |
| Complexity | 873.742 |
Chemical Identifiers
| CAS Number | 876717-40-7 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=CC=C1C(=O)N)SC2=NC3=CC=CC=C3O2 |
Product Overview
2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide (CAS 876717-40-7), with molecular formula C17H15N3O3S and molecular weight 341.08 g/mol. IUPAC: 2-[2-(1,3-benzoxazol-2-ylsulfanyl)propanoylamino]benzamide.
Chemical Property Profile of 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide
Property Insights of 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide
The XLogP value of 3.046 indicates that 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide. Following Lipinski's Rule of Five, 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide has 2 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 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide?
The CAS number of 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide is 876717-40-7.
What is the molecular formula of 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide?
The molecular formula of 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide is C17H15N3O3S.
What is the molecular weight of 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide?
The molecular weight of 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide is 341.08 g/mol.
Where can I buy 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide?
You can request a quote for 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-(1,3-Benzoxazol-2-ylsulfanyl)propanoyl]amino}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.