1-(4-Methylanilino)-3-phenylthiourea
TL;DR: 1-(4-Methylanilino)-3-phenylthiourea (CAS 56864-62-1) is a chemical compound with molecular formula C14H15N3S and molecular weight 257.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylanilino)-3-phenylthiourea
Also Known As: 1-(4-methylanilino)-3-phenylthiourea, 4-phenyl-1-p-tolyl-thiosemicarbazide, 1-(4-Methylphenyl)-4-phenylthiosemicarbazide, Hydrazinecarbothioamide, 2-(4-methylphenyl)-N-phenyl-, 1-[(4-methylphenyl)amino]-3-phenyl-thiourea
| Molecular Formula | C14H15N3S |
|---|---|
| Molecular Weight | 257.10 g/mol |
| LogP | 3.30852 |
| Topological Polar Surface Area | 36.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.09866 |
| Heavy Atoms | 18 |
| Complexity | 508.32214 |
Chemical Identifiers
| CAS Number | 56864-62-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NNC(=S)NC2=CC=CC=C2 |
Product Overview
1-(4-Methylanilino)-3-phenylthiourea (CAS 56864-62-1), with molecular formula C14H15N3S and molecular weight 257.10 g/mol. IUPAC: 1-(4-methylanilino)-3-phenylthiourea.
Chemical Property Profile of 1-(4-Methylanilino)-3-phenylthiourea
Property Insights of 1-(4-Methylanilino)-3-phenylthiourea
The XLogP value of 3.30852 indicates that 1-(4-Methylanilino)-3-phenylthiourea 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-(4-Methylanilino)-3-phenylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylanilino)-3-phenylthiourea has 3 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-(4-Methylanilino)-3-phenylthiourea?
The CAS number of 1-(4-Methylanilino)-3-phenylthiourea is 56864-62-1.
What is the molecular formula of 1-(4-Methylanilino)-3-phenylthiourea?
The molecular formula of 1-(4-Methylanilino)-3-phenylthiourea is C14H15N3S.
What is the molecular weight of 1-(4-Methylanilino)-3-phenylthiourea?
The molecular weight of 1-(4-Methylanilino)-3-phenylthiourea is 257.10 g/mol.
Where can I buy 1-(4-Methylanilino)-3-phenylthiourea?
You can request a quote for 1-(4-Methylanilino)-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-(4-Methylanilino)-3-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylanilino)-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.