(2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide
TL;DR: (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide (CAS 302562-52-3) is a chemical compound with molecular formula C15H14BrN3S and molecular weight 347.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-[(E)-(2-bromophenyl)methylideneamino]thiourea
Also Known As: AB01331638-02, (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide, 1-benzyl-3-[(2-bromophenyl)methylideneamino]thiourea, (E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide, 1-benzyl-3-[(E)-(2-bromophenyl)methylideneamino]thiourea
| Molecular Formula | C15H14BrN3S |
|---|---|
| Molecular Weight | 347.01 g/mol |
| LogP | 3.4473 |
| Topological Polar Surface Area | 36.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.0092 |
| Heavy Atoms | 20 |
| Complexity | 599.07745 |
Chemical Identifiers
| CAS Number | 302562-52-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=S)N/N=C/C2=CC=CC=C2Br |
Product Overview
(2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide (CAS 302562-52-3), with molecular formula C15H14BrN3S and molecular weight 347.01 g/mol. IUPAC: 1-benzyl-3-[(E)-(2-bromophenyl)methylideneamino]thiourea.
Chemical Property Profile of (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide
Property Insights of (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide
The XLogP value of 3.4473 indicates that (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.42 Ų, (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide has 2 hydrogen bond donor(s) and 2 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 (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide?
The CAS number of (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide is 302562-52-3.
What is the molecular formula of (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide?
The molecular formula of (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide is C15H14BrN3S.
What is the molecular weight of (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide?
The molecular weight of (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide is 347.01 g/mol.
Where can I buy (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide?
You can request a quote for (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-benzyl-2-(2-bromobenzylidene)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.