N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide
TL;DR: N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide (CAS 476295-63-3) is a chemical compound with molecular formula C16H13BrN2O2S and molecular weight 375.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide
Also Known As: IFLab1_001585, N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide, N-(6-bromobenzo[d]thiazol-2-yl)-3-phenoxypropanamide, AB00667720-01, F0375-0201
| Molecular Formula | C16H13BrN2O2S |
|---|---|
| Molecular Weight | 375.99 g/mol |
| LogP | 4.4664 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.9881 |
| Heavy Atoms | 22 |
| Complexity | 789.19995 |
Chemical Identifiers
| CAS Number | 476295-63-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br |
Product Overview
N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide (CAS 476295-63-3), with molecular formula C16H13BrN2O2S and molecular weight 375.99 g/mol. IUPAC: N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide.
Chemical Property Profile of N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide
Property Insights of N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide
The XLogP value of 4.4664 indicates that N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide has 1 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 N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
The CAS number of N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide is 476295-63-3.
What is the molecular formula of N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
The molecular formula of N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide is C16H13BrN2O2S.
What is the molecular weight of N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
The molecular weight of N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide is 375.99 g/mol.
Where can I buy N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
You can request a quote for N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenoxypropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.