N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide
TL;DR: N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide (CAS 369400-63-5) is a chemical compound with molecular formula C15H9ClIN3OS2 and molecular weight 472.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide
Also Known As: N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide, N-(benzo[d]thiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide, N-(benzothiazol-2-ylthiocarbamoyl)-2-chloro-5-iodo-benzamide
| Molecular Formula | C15H9ClIN3OS2 |
|---|---|
| Molecular Weight | 472.89 g/mol |
| LogP | 4.6811 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 472.89203 |
| Heavy Atoms | 23 |
| Complexity | 879.6283 |
Chemical Identifiers
| CAS Number | 369400-63-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=S)NC(=O)C3=C(C=CC(=C3)I)Cl |
Product Overview
N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide (CAS 369400-63-5), with molecular formula C15H9ClIN3OS2 and molecular weight 472.89 g/mol. IUPAC: N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide
Property Insights of N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide
The XLogP value of 4.6811 indicates that N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide has 2 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 N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide?
The CAS number of N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide is 369400-63-5.
What is the molecular formula of N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide?
The molecular formula of N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide is C15H9ClIN3OS2.
What is the molecular weight of N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide?
The molecular weight of N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide is 472.89 g/mol.
Where can I buy N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide?
You can request a quote for N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-ylcarbamothioyl)-2-chloro-5-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.