2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide
TL;DR: 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide (CAS 873856-45-2) is a chemical compound with molecular formula C17H17N3OS and molecular weight 311.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide
Also Known As: 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide, 2-(benzo[d]thiazol-2-yl)-N,N-diethylnicotinamide, VU0608930-1, AB01291828-01, F3290-0053
| Molecular Formula | C17H17N3OS |
|---|---|
| Molecular Weight | 311.11 g/mol |
| LogP | 3.8403 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.10922 |
| Heavy Atoms | 22 |
| Complexity | 775.27905 |
Chemical Identifiers
| CAS Number | 873856-45-2 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(N=CC=C1)C2=NC3=CC=CC=C3S2 |
Product Overview
2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide (CAS 873856-45-2), with molecular formula C17H17N3OS and molecular weight 311.11 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide.
Chemical Property Profile of 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide
Property Insights of 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide
The XLogP value of 3.8403 indicates that 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide has 0 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 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide?
The CAS number of 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide is 873856-45-2.
What is the molecular formula of 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide?
The molecular formula of 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide is C17H17N3OS.
What is the molecular weight of 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide?
The molecular weight of 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide is 311.11 g/mol.
Where can I buy 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide?
You can request a quote for 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzothiazol-2-yl)-N,N-diethylpyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.