![[(2-Methyl-1-phenylpropylidene)amino]thiourea structure](/static/products/419/41904-33-0.png)
[(2-Methyl-1-phenylpropylidene)amino]thiourea
TL;DR: [(2-Methyl-1-phenylpropylidene)amino]thiourea (CAS 41904-33-0) is a chemical compound with molecular formula C11H15N3S and molecular weight 221.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2-methyl-1-phenylpropylidene)amino]thiourea
Also Known As: [(2-methyl-1-phenylpropylidene)amino]thiourea, 2-methyl-1-phenyl-1-propanone thiosemicarbazone, AN-329/40239009, 2-(2-methyl-1-phenylpropylidene)hydrazinecarbothioamide
| Molecular Formula | C11H15N3S |
|---|---|
| Molecular Weight | 221.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.09866 |
| Heavy Atoms | 15 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 41904-33-0 |
|---|---|
| SMILES | CC(C)C(=NNC(=S)N)C1=CC=CC=C1 |
| InChIKey | VMXPXGKCZXQSMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[(2-Methyl-1-phenylpropylidene)amino]thiourea (CAS 41904-33-0), with molecular formula C11H15N3S and molecular weight 221.10 g/mol. IUPAC: [(2-methyl-1-phenylpropylidene)amino]thiourea.
Chemical Property Profile of [(2-Methyl-1-phenylpropylidene)amino]thiourea
Property Insights of [(2-Methyl-1-phenylpropylidene)amino]thiourea
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Methyl-1-phenylpropylidene)amino]thiourea. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-Methyl-1-phenylpropylidene)amino]thiourea. Following Lipinski's Rule of Five, [(2-Methyl-1-phenylpropylidene)amino]thiourea 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 [(2-Methyl-1-phenylpropylidene)amino]thiourea?
The CAS number of [(2-Methyl-1-phenylpropylidene)amino]thiourea is 41904-33-0.
What is the molecular formula of [(2-Methyl-1-phenylpropylidene)amino]thiourea?
The molecular formula of [(2-Methyl-1-phenylpropylidene)amino]thiourea is C11H15N3S.
What is the molecular weight of [(2-Methyl-1-phenylpropylidene)amino]thiourea?
The molecular weight of [(2-Methyl-1-phenylpropylidene)amino]thiourea is 221.10 g/mol.
Where can I buy [(2-Methyl-1-phenylpropylidene)amino]thiourea?
You can request a quote for [(2-Methyl-1-phenylpropylidene)amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-Methyl-1-phenylpropylidene)amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(2-Methyl-1-phenylpropylidene)amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.