1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea
TL;DR: 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea (CAS 433320-28-6) is a chemical compound with molecular formula C11H13ClN2OS and molecular weight 256.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2-methoxyphenyl)-3-prop-2-enylthiourea
Also Known As: N-allyl-N'-(5-chloro-2-methoxyphenyl)thiourea, 1-(5-chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea, 1-(5-chloro-2-methoxyphenyl)-3-prop-2-enylthiourea, 1-allyl-3-(5-chloro-2-methoxy-phenyl)thiourea, 1-Allyl-3-(5-chloro-2-methoxy-phenyl)-thiourea
| Molecular Formula | C11H13ClN2OS |
|---|---|
| Molecular Weight | 256.04 g/mol |
| LogP | 2.821 |
| Topological Polar Surface Area | 33.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.0437 |
| Heavy Atoms | 16 |
| Complexity | 395.57098 |
Chemical Identifiers
| CAS Number | 433320-28-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)NC(=S)NCC=C |
Product Overview
1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea (CAS 433320-28-6), with molecular formula C11H13ClN2OS and molecular weight 256.04 g/mol. IUPAC: 1-(5-chloro-2-methoxyphenyl)-3-prop-2-enylthiourea.
Chemical Property Profile of 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea
Property Insights of 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea
The XLogP value of 2.821 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea. With a topological polar surface area (TPSA) of 33.29 Ų, 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea 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 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea?
The CAS number of 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea is 433320-28-6.
What is the molecular formula of 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea?
The molecular formula of 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea is C11H13ClN2OS.
What is the molecular weight of 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea?
The molecular weight of 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea is 256.04 g/mol.
Where can I buy 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea?
You can request a quote for 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Chloro-2-methoxyphenyl)-3-prop-2-en-1-ylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.