(2-Phenylanilino)thiourea
TL;DR: (2-Phenylanilino)thiourea (CAS 860609-71-8) is a chemical compound with molecular formula C13H13N3S and molecular weight 243.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-phenylanilino)thiourea
Also Known As: (2-phenylanilino)thiourea, ({[1,1'-biphenyl]-2-yl}amino)thiourea, 2-[1,1'-biphenyl]-2-yl-1-hydrazinecarbothioamide, 10N-008
| Molecular Formula | C13H13N3S |
|---|---|
| Molecular Weight | 243.08 g/mol |
| LogP | 2.5137 |
| Topological Polar Surface Area | 50.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.08302 |
| Heavy Atoms | 17 |
| Complexity | 511.08286 |
Chemical Identifiers
| CAS Number | 860609-71-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=CC=C2NNC(=S)N |
Product Overview
(2-Phenylanilino)thiourea (CAS 860609-71-8), with molecular formula C13H13N3S and molecular weight 243.08 g/mol. IUPAC: (2-phenylanilino)thiourea.
Chemical Property Profile of (2-Phenylanilino)thiourea
Property Insights of (2-Phenylanilino)thiourea
The XLogP value of 2.5137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Phenylanilino)thiourea. With a topological polar surface area (TPSA) of 50.08 Ų, (2-Phenylanilino)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Phenylanilino)thiourea 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 (2-Phenylanilino)thiourea?
The CAS number of (2-Phenylanilino)thiourea is 860609-71-8.
What is the molecular formula of (2-Phenylanilino)thiourea?
The molecular formula of (2-Phenylanilino)thiourea is C13H13N3S.
What is the molecular weight of (2-Phenylanilino)thiourea?
The molecular weight of (2-Phenylanilino)thiourea is 243.08 g/mol.
Where can I buy (2-Phenylanilino)thiourea?
You can request a quote for (2-Phenylanilino)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Phenylanilino)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (2-Phenylanilino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.