![N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide structure](/static/products/6407/6407-57-4.webp)
N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide
TL;DR: N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide (CAS 6407-57-4) is a chemical compound with molecular formula C21H14IN3O2S and molecular weight 498.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-iodobenzamide
Also Known As: N-{[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-2-iodobenzamide, N-[(3-BENZO[D]OXAZOL-2-YLPHENYL)THIOCARBAMOYL]-2-IODO-BENZAMIDE, N-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-iodobenzamide, N-({[3-(1,3-benzoxazol-2-yl)phenyl]amino}carbonothioyl)-2-iodobenzamide
| Molecular Formula | C21H14IN3O2S |
|---|---|
| Molecular Weight | 498.99 g/mol |
| LogP | 5.2262 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 498.98514 |
| Heavy Atoms | 28 |
| Complexity | 1155.973 |
Chemical Identifiers
| CAS Number | 6407-57-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3)I |
Product Overview
N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide (CAS 6407-57-4), with molecular formula C21H14IN3O2S and molecular weight 498.99 g/mol. IUPAC: N-[[3-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-iodobenzamide.
Chemical Property Profile of N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide
Property Insights of N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide
The XLogP value of 5.2262 indicates that N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide. Following Lipinski's Rule of Five, N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide?
The CAS number of N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide is 6407-57-4.
What is the molecular formula of N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide?
The molecular formula of N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide is C21H14IN3O2S.
What is the molecular weight of N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide?
The molecular weight of N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide is 498.99 g/mol.
Where can I buy N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide?
You can request a quote for N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-Benzo[D]oxazol-2-ylphenyl)thiocarbamoyl]-2-iodo-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.