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N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide
TL;DR: N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide (CAS 701925-80-6) 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.
N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide
Also Known As: N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide
| Molecular Formula | C17H15ClN2OS |
|---|---|
| Molecular Weight | 330.06 g/mol |
| LogP | 5.3553 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.05936 |
| Heavy Atoms | 22 |
| Complexity | 795.3919 |
Chemical Identifiers
| CAS Number | 701925-80-6 |
|---|---|
| SMILES | CCCC(=O)NC1=C(C=C(C=C1)Cl)C2=NC3=CC=CC=C3S2 |
Product Overview
N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide (CAS 701925-80-6), with molecular formula C17H15ClN2OS and molecular weight 330.06 g/mol. IUPAC: N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide.
Chemical Property Profile of N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide
Property Insights of N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide
The XLogP value of 5.3553 indicates that N-[2-(1,3-benzothiazol-2-yl)-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, N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide?
The CAS number of N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide is 701925-80-6.
What is the molecular formula of N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide?
The molecular formula of N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide is C17H15ClN2OS.
What is the molecular weight of N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide?
The molecular weight of N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide is 330.06 g/mol.
Where can I buy N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide?
You can request a quote for N-[2-(1,3-benzothiazol-2-yl)-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 N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.