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1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea
TL;DR: 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea (CAS 468087-16-3) is a chemical compound with molecular formula C16H17N3OS and molecular weight 299.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-ethoxyphenyl)methylideneamino]-3-phenylthiourea
Also Known As: 2-ethoxybenzaldehyde N-phenylthiosemicarbazone, 1-[(2-ethoxyphenyl)methylideneamino]-3-phenylthiourea
| Molecular Formula | C16H17N3OS |
|---|---|
| Molecular Weight | 299.11 g/mol |
| LogP | 3.4058 |
| Topological Polar Surface Area | 45.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.10922 |
| Heavy Atoms | 21 |
| Complexity | 613.92896 |
Chemical Identifiers
| CAS Number | 468087-16-3 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C=NNC(=S)NC2=CC=CC=C2 |
Product Overview
1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea (CAS 468087-16-3), with molecular formula C16H17N3OS and molecular weight 299.11 g/mol. IUPAC: 1-[(2-ethoxyphenyl)methylideneamino]-3-phenylthiourea.
Chemical Property Profile of 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea
Property Insights of 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea
The XLogP value of 3.4058 indicates that 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.65 Ų, 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea has 2 hydrogen bond donor(s) and 3 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 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea?
The CAS number of 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea is 468087-16-3.
What is the molecular formula of 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea?
The molecular formula of 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea is C16H17N3OS.
What is the molecular weight of 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea?
The molecular weight of 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea is 299.11 g/mol.
Where can I buy 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea?
You can request a quote for 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Ethoxyphenyl)methylideneamino]-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.