AN-329/40200599
TL;DR: AN-329/40200599 (CAS 314765-52-1) is a chemical compound with molecular formula C17H18BrN3O2S and molecular weight 407.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-(5-bromo-2,4-dimethoxyphenyl)methylideneamino]-3-(3-methylphenyl)thiourea
Also Known As: AN-329/40200599, 5-bromo-2,4-dimethoxybenzaldehyde N-(3-methylphenyl)thiosemicarbazone, (2E)-2-(5-bromo-2,4-dimethoxybenzylidene)-N-(3-methylphenyl)hydrazinecarbothioamide, 1-[(E)-(5-bromo-2,4-dimethoxyphenyl)methylideneamino]-3-(3-methylphenyl)thiourea
| Molecular Formula | C17H18BrN3O2S |
|---|---|
| Molecular Weight | 407.03 g/mol |
| LogP | 4.09522 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.0303 |
| Heavy Atoms | 24 |
| Complexity | 765.49603 |
Chemical Identifiers
| CAS Number | 314765-52-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=S)N/N=C/C2=CC(=C(C=C2OC)OC)Br |
Product Overview
AN-329/40200599 (CAS 314765-52-1), with molecular formula C17H18BrN3O2S and molecular weight 407.03 g/mol. IUPAC: 1-[(E)-(5-bromo-2,4-dimethoxyphenyl)methylideneamino]-3-(3-methylphenyl)thiourea.
Chemical Property Profile of AN-329/40200599
Property Insights of AN-329/40200599
The XLogP value of 4.09522 indicates that AN-329/40200599 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, AN-329/40200599 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-329/40200599 has 2 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 AN-329/40200599?
The CAS number of AN-329/40200599 is 314765-52-1.
What is the molecular formula of AN-329/40200599?
The molecular formula of AN-329/40200599 is C17H18BrN3O2S.
What is the molecular weight of AN-329/40200599?
The molecular weight of AN-329/40200599 is 407.03 g/mol.
Where can I buy AN-329/40200599?
You can request a quote for AN-329/40200599 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/40200599?
Yes, KEHONG BIO provides custom synthesis services for AN-329/40200599 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.