![1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea structure](/static/products/5164/516457-22-0.webp)
1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea
TL;DR: 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea (CAS 516457-22-0) is a chemical compound with molecular formula C22H23N3S2 and molecular weight 393.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-anilinophenyl)-3-[2-(4-methylphenyl)sulfanylethyl]thiourea
Also Known As: AB01324287-02, 1-{2-[(4-methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea, 1-(4-(phenylamino)phenyl)-3-(2-(p-tolylthio)ethyl)thiourea, 1-(4-anilinophenyl)-3-[2-(4-methylphenyl)sulfanylethyl]thiourea, N-(4-ANILINOPHENYL)-N'-{2-[(4-METHYLPHENYL)SULFANYL]ETHYL}THIOUREA
| Molecular Formula | C22H23N3S2 |
|---|---|
| Molecular Weight | 393.13 g/mol |
| LogP | 5.81732 |
| Topological Polar Surface Area | 36.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 393.13333 |
| Heavy Atoms | 27 |
| Complexity | 846.9911 |
Chemical Identifiers
| CAS Number | 516457-22-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCCNC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3 |
Product Overview
1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea (CAS 516457-22-0), with molecular formula C22H23N3S2 and molecular weight 393.13 g/mol. IUPAC: 1-(4-anilinophenyl)-3-[2-(4-methylphenyl)sulfanylethyl]thiourea.
Chemical Property Profile of 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea
Property Insights of 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea
The XLogP value of 5.81732 indicates that 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.09 Ų, 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea?
The CAS number of 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea is 516457-22-0.
What is the molecular formula of 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea?
The molecular formula of 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea is C22H23N3S2.
What is the molecular weight of 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea?
The molecular weight of 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea is 393.13 g/mol.
Where can I buy 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea?
You can request a quote for 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-{2-[(4-Methylphenyl)sulfanyl]ethyl}-3-[4-(phenylamino)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.