N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide
TL;DR: N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide (CAS 313660-12-7) is a chemical compound with molecular formula C21H15BrN2OS and molecular weight 422.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide
Also Known As: F0014-0100, N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide, N-[(2E)-6-bromo-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-[1,1'-biphenyl]-4-carboxamide, (E)-N-(6-bromo-3-methylbenzo[d]thiazol-2(3H)-ylidene)-[1,1'-biphenyl]-4-carboxamide, N-(6-bromo-3-methyl-benzothiazol-2-ylidene)-4-phenyl-benzamide
| Molecular Formula | C21H15BrN2OS |
|---|---|
| Molecular Weight | 422.01 g/mol |
| LogP | 5.4104 |
| Topological Polar Surface Area | 34.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 422.00885 |
| Heavy Atoms | 26 |
| Complexity | 1158.3181 |
Chemical Identifiers
| CAS Number | 313660-12-7 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)Br)SC1=NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4 |
Product Overview
N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide (CAS 313660-12-7), with molecular formula C21H15BrN2OS and molecular weight 422.01 g/mol. IUPAC: N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide.
Chemical Property Profile of N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide
Property Insights of N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide
The XLogP value of 5.4104 indicates that N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.36 Ų, N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide?
The CAS number of N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide is 313660-12-7.
What is the molecular formula of N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide?
The molecular formula of N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide is C21H15BrN2OS.
What is the molecular weight of N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide?
The molecular weight of N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide is 422.01 g/mol.
Where can I buy N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide?
You can request a quote for N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide 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-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.