[[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea
TL;DR: [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea (CAS 1025258-26-7) is a chemical compound with molecular formula C14H11BrN4O3S and molecular weight 393.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[2-(4-bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea
Also Known As: [[2-(4-bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea, amino((1-aza-2-(2-(4-bromophenoxy)-5-nitrophenyl)vinyl)amino)methane-1-thione, [[2-(4-bromophenoxy)-5-nitro-phenyl]methyleneamino]thiourea, [[2-(4-bromophenoxy)-5-nitro-phenyl]methylideneamino]thiourea, [(E)-{[2-(4-bromophenoxy)-5-nitrophenyl]methylidene}amino]thiourea
| Molecular Formula | C14H11BrN4O3S |
|---|---|
| Molecular Weight | 393.97 g/mol |
| LogP | 3.3167 |
| Topological Polar Surface Area | 102.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.9735 |
| Heavy Atoms | 23 |
| Complexity | 765.11774 |
Chemical Identifiers
| CAS Number | 1025258-26-7 |
|---|---|
| SMILES | C1=CC(=CC=C1OC2=C(C=C(C=C2)[N+](=O)[O-])C=NNC(=S)N)Br |
Product Overview
[[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea (CAS 1025258-26-7), with molecular formula C14H11BrN4O3S and molecular weight 393.97 g/mol. IUPAC: [[2-(4-bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea.
Chemical Property Profile of [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea
Property Insights of [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea
The XLogP value of 3.3167 indicates that [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.78 Ų falls within the moderate polarity range, balancing permeability and solubility for [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea. Following Lipinski's Rule of Five, [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea has 2 hydrogen bond donor(s) and 5 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 [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea?
The CAS number of [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea is 1025258-26-7.
What is the molecular formula of [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea?
The molecular formula of [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea is C14H11BrN4O3S.
What is the molecular weight of [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea?
The molecular weight of [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea is 393.97 g/mol.
Where can I buy [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea?
You can request a quote for [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [[2-(4-Bromophenoxy)-5-nitrophenyl]methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.