1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea
TL;DR: 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea (CAS 219996-93-7) is a chemical compound with molecular formula C15H15N3OS and molecular weight 285.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea
Also Known As: 4-(methylsulfanyl)benzaldehyde N-phenylsemicarbazone, BAS 00484982, AB00075132-01, 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea, AN-329/40184124
| Molecular Formula | C15H15N3OS |
|---|---|
| Molecular Weight | 285.09 g/mol |
| LogP | 3.5641 |
| Topological Polar Surface Area | 53.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.0936 |
| Heavy Atoms | 20 |
| Complexity | 581.82745 |
Chemical Identifiers
| CAS Number | 219996-93-7 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)/C=N/NC(=O)NC2=CC=CC=C2 |
Product Overview
1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea (CAS 219996-93-7), with molecular formula C15H15N3OS and molecular weight 285.09 g/mol. IUPAC: 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea.
Chemical Property Profile of 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea
Property Insights of 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea
The XLogP value of 3.5641 indicates that 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.49 Ų, 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea 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-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea?
The CAS number of 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea is 219996-93-7.
What is the molecular formula of 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea?
The molecular formula of 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea is C15H15N3OS.
What is the molecular weight of 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea?
The molecular weight of 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea is 285.09 g/mol.
Where can I buy 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea?
You can request a quote for 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.