N-(1,3-benzothiazol-2-yl)-2-methylbutanamide
TL;DR: N-(1,3-benzothiazol-2-yl)-2-methylbutanamide (CAS 349415-83-4) is a chemical compound with molecular formula C12H14N2OS and molecular weight 234.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-2-methylbutanamide
Also Known As: N-(1,3-benzothiazol-2-yl)-2-methylbutanamide, N-(Benzo[d]thiazol-2-yl)-2-methylbutanamide, AJ-292/14129020
| Molecular Formula | C12H14N2OS |
|---|---|
| Molecular Weight | 234.08 g/mol |
| LogP | 3.2809 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.08269 |
| Heavy Atoms | 16 |
| Complexity | 473.443 |
Chemical Identifiers
| CAS Number | 349415-83-4 |
|---|---|
| SMILES | CCC(C)C(=O)NC1=NC2=CC=CC=C2S1 |
Product Overview
N-(1,3-benzothiazol-2-yl)-2-methylbutanamide (CAS 349415-83-4), with molecular formula C12H14N2OS and molecular weight 234.08 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2-methylbutanamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-2-methylbutanamide
Property Insights of N-(1,3-benzothiazol-2-yl)-2-methylbutanamide
The XLogP value of 3.2809 indicates that N-(1,3-benzothiazol-2-yl)-2-methylbutanamide 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)-2-methylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-2-methylbutanamide 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)-2-methylbutanamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-2-methylbutanamide is 349415-83-4.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-2-methylbutanamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-2-methylbutanamide is C12H14N2OS.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-2-methylbutanamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-2-methylbutanamide is 234.08 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-2-methylbutanamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-2-methylbutanamide 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)-2-methylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-2-methylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.