2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide
TL;DR: 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide (CAS 5381-94-2) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-hydroxy-4-phenylbutan-2-ylidene)amino]urea
Also Known As: 4-hydroxy-4-phenyl-butan-2-one semicarbazone, 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide, 2-(4-Hydroxy-4-phenylbutan-2-ylidene)hydrazine-1-carboxamide
| Molecular Formula | C11H15N3O2 |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.11642 |
| Heavy Atoms | 16 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 5381-94-2 |
|---|---|
| SMILES | CC(=NNC(=O)N)CC(C1=CC=CC=C1)O |
| InChIKey | GGBRBTGLTQVTGG-UHFFFAOYSA-N |
Product Overview
2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide (CAS 5381-94-2), with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol. IUPAC: [(4-hydroxy-4-phenylbutan-2-ylidene)amino]urea.
Chemical Property Profile of 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide
Property Insights of 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide
The XLogP value of -0.1 indicates that 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide. Following Lipinski's Rule of Five, 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide has 3 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 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide?
The CAS number of 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide is 5381-94-2.
What is the molecular formula of 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide?
The molecular formula of 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide is C11H15N3O2.
What is the molecular weight of 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide?
The molecular weight of 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide is 221.12 g/mol.
Where can I buy 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide?
You can request a quote for 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Hydroxy-1-methyl-3-phenylpropylidene)hydrazinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.