N-(1,3-benzothiazol-2-yl)-3-iodobenzamide
TL;DR: N-(1,3-benzothiazol-2-yl)-3-iodobenzamide (CAS 313499-59-1) is a chemical compound with molecular formula C14H9IN2OS and molecular weight 379.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-3-iodobenzamide
Also Known As: N-(1,3-benzothiazol-2-yl)-3-iodobenzamide, N-2-Benzothiazolyl-3-iodobenzamide, AN-652/33507054
| Molecular Formula | C14H9IN2OS |
|---|---|
| Molecular Weight | 379.95 g/mol |
| LogP | 4.1532 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 379.94803 |
| Heavy Atoms | 19 |
| Complexity | 720.7956 |
Chemical Identifiers
| CAS Number | 313499-59-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)I |
Product Overview
N-(1,3-benzothiazol-2-yl)-3-iodobenzamide (CAS 313499-59-1), with molecular formula C14H9IN2OS and molecular weight 379.95 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-3-iodobenzamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-3-iodobenzamide
Property Insights of N-(1,3-benzothiazol-2-yl)-3-iodobenzamide
The XLogP value of 4.1532 indicates that N-(1,3-benzothiazol-2-yl)-3-iodobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-(1,3-benzothiazol-2-yl)-3-iodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-3-iodobenzamide has 1 hydrogen bond donor(s) and 3 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-yl)-3-iodobenzamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-3-iodobenzamide is 313499-59-1.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-3-iodobenzamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-3-iodobenzamide is C14H9IN2OS.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-3-iodobenzamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-3-iodobenzamide is 379.95 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-3-iodobenzamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-3-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-yl)-3-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-3-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.