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N-[Benzo[d]thiazol-2-yl]nicotinamide
TL;DR: N-[Benzo[d]thiazol-2-yl]nicotinamide (CAS 121189-78-4) is a chemical compound with molecular formula C13H9N3OS and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)pyridine-3-carboxamide
Also Known As: N-(1,3-benzothiazol-2-yl)pyridine-3-carboxamide, N-[Benzo[d]thiazol-2-yl]nicotinamide, N-Benzothiazol-2-yl-nicotinamide, n-(benzo[d]thiazol-2-yl)nicotinamide, N-(1,3-Benzothiazol-2-yl)nicotinamide
| Molecular Formula | C13H9N3OS |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.04663 |
| Heavy Atoms | 18 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 121189-78-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CN=CC=C3 |
| InChIKey | UWUNYOLFEWOXPK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-[Benzo[d]thiazol-2-yl]nicotinamide (CAS 121189-78-4), with molecular formula C13H9N3OS and molecular weight 255.05 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)pyridine-3-carboxamide.
Chemical Property Profile of N-[Benzo[d]thiazol-2-yl]nicotinamide
Property Insights of N-[Benzo[d]thiazol-2-yl]nicotinamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[Benzo[d]thiazol-2-yl]nicotinamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[Benzo[d]thiazol-2-yl]nicotinamide. Following Lipinski's Rule of Five, N-[Benzo[d]thiazol-2-yl]nicotinamide has 1 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-[Benzo[d]thiazol-2-yl]nicotinamide?
The CAS number of N-[Benzo[d]thiazol-2-yl]nicotinamide is 121189-78-4.
What is the molecular formula of N-[Benzo[d]thiazol-2-yl]nicotinamide?
The molecular formula of N-[Benzo[d]thiazol-2-yl]nicotinamide is C13H9N3OS.
What is the molecular weight of N-[Benzo[d]thiazol-2-yl]nicotinamide?
The molecular weight of N-[Benzo[d]thiazol-2-yl]nicotinamide is 255.05 g/mol.
Where can I buy N-[Benzo[d]thiazol-2-yl]nicotinamide?
You can request a quote for N-[Benzo[d]thiazol-2-yl]nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[Benzo[d]thiazol-2-yl]nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-[Benzo[d]thiazol-2-yl]nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.