ChemDiv2_004739
TL;DR: ChemDiv2_004739 (CAS 663168-84-1) is a chemical compound with molecular formula C16H15N3O3S and molecular weight 329.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxo-1,3-benzoxazol-3-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
Also Known As: ChemDiv2_004739, IDI1_003454, BAS 06761106, F5860-4235, 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
| Molecular Formula | C16H15N3O3S |
|---|---|
| Molecular Weight | 329.08 g/mol |
| LogP | 2.5685 |
| Topological Polar Surface Area | 77.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.0834 |
| Heavy Atoms | 23 |
| Complexity | 914.09326 |
Chemical Identifiers
| CAS Number | 663168-84-1 |
|---|---|
| SMILES | C1CCC2=C(C1)N=C(S2)NC(=O)CN3C4=CC=CC=C4OC3=O |
Product Overview
ChemDiv2_004739 (CAS 663168-84-1), with molecular formula C16H15N3O3S and molecular weight 329.08 g/mol. IUPAC: 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide.
Chemical Property Profile of ChemDiv2_004739
Property Insights of ChemDiv2_004739
The XLogP value of 2.5685 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_004739. The TPSA of 77.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_004739. Following Lipinski's Rule of Five, ChemDiv2_004739 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 ChemDiv2_004739?
The CAS number of ChemDiv2_004739 is 663168-84-1.
What is the molecular formula of ChemDiv2_004739?
The molecular formula of ChemDiv2_004739 is C16H15N3O3S.
What is the molecular weight of ChemDiv2_004739?
The molecular weight of ChemDiv2_004739 is 329.08 g/mol.
Where can I buy ChemDiv2_004739?
You can request a quote for ChemDiv2_004739 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_004739?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_004739 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.