N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide
TL;DR: N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide (CAS 331260-86-7) is a chemical compound with molecular formula C16H10BrClN2OS and molecular weight 391.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(3-bromophenyl)methylideneamino]-3-chloro-1-benzothiophene-2-carboxamide
Also Known As: BAS 00364989, N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide, N-[(E)-(3-bromophenyl)methylideneamino]-3-chloro-1-benzothiophene-2-carboxamide, 3-Chloro-benzo[b]thiophene-2-carboxylic acid (3-bromo-benzylidene)-hydrazide, N'-[(E)-(3-bromophenyl)methylidene]-3-chloro-1-benzothiophene-2-carbohydrazide
| Molecular Formula | C16H10BrClN2OS |
|---|---|
| Molecular Weight | 391.94 g/mol |
| LogP | 5.0811 |
| Topological Polar Surface Area | 41.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.93857 |
| Heavy Atoms | 22 |
| Complexity | 875.46326 |
Chemical Identifiers
| CAS Number | 331260-86-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C(=O)N/N=C/C3=CC(=CC=C3)Br)Cl |
Product Overview
N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide (CAS 331260-86-7), with molecular formula C16H10BrClN2OS and molecular weight 391.94 g/mol. IUPAC: N-[(E)-(3-bromophenyl)methylideneamino]-3-chloro-1-benzothiophene-2-carboxamide.
Chemical Property Profile of N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide
Property Insights of N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide
The XLogP value of 5.0811 indicates that N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.46 Ų, N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide 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'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide?
The CAS number of N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide is 331260-86-7.
What is the molecular formula of N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide?
The molecular formula of N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide is C16H10BrClN2OS.
What is the molecular weight of N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide?
The molecular weight of N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide is 391.94 g/mol.
Where can I buy N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide?
You can request a quote for N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-(3-bromobenzylidene)-3-chloro-1-benzothiophene-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.