4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide
TL;DR: 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide (CAS 449168-10-9) is a chemical compound with molecular formula C12H13ClN2OS and molecular weight 268.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide
Also Known As: 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide, 4-chloro-N-(6-methylbenzothiazol-2-yl)butanamide, AP-906/41250417, 4-Chloro-N-(6-methylbenzo[d]thiazol-2-yl)butanamide, 4-chloro-N-(6-methyl-benzo[d]thiazol-2-yl)-butanamide
| Molecular Formula | C12H13ClN2OS |
|---|---|
| Molecular Weight | 268.04 g/mol |
| LogP | 3.56222 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.0437 |
| Heavy Atoms | 17 |
| Complexity | 538.2852 |
Chemical Identifiers
| CAS Number | 449168-10-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCCl |
Product Overview
4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide (CAS 449168-10-9), with molecular formula C12H13ClN2OS and molecular weight 268.04 g/mol. IUPAC: 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide.
Chemical Property Profile of 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide
Property Insights of 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide
The XLogP value of 3.56222 indicates that 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide 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 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide?
The CAS number of 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide is 449168-10-9.
What is the molecular formula of 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide?
The molecular formula of 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide is C12H13ClN2OS.
What is the molecular weight of 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide?
The molecular weight of 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide is 268.04 g/mol.
Where can I buy 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide?
You can request a quote for 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.