4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide
TL;DR: 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide (CAS 950129-48-3) is a chemical compound with molecular formula C17H15ClN2OS and molecular weight 330.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide
Also Known As: 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide, AB00793640-01, 4-benzothiazol-2-yl-N-(4-chlorophenyl)butanamide
| Molecular Formula | C17H15ClN2OS |
|---|---|
| Molecular Weight | 330.06 g/mol |
| LogP | 4.9111 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.05936 |
| Heavy Atoms | 22 |
| Complexity | 749.7131 |
Chemical Identifiers
| CAS Number | 950129-48-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide (CAS 950129-48-3), with molecular formula C17H15ClN2OS and molecular weight 330.06 g/mol. IUPAC: 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide.
Chemical Property Profile of 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide
Property Insights of 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide
The XLogP value of 4.9111 indicates that 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)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-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)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-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide?
The CAS number of 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide is 950129-48-3.
What is the molecular formula of 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide?
The molecular formula of 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide is C17H15ClN2OS.
What is the molecular weight of 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide?
The molecular weight of 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide is 330.06 g/mol.
Where can I buy 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide?
You can request a quote for 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.