苯乙酰脲
TL;DR: 苯乙酰脲 (CAS 63-98-9) is a chemical compound with molecular formula C9H10N2O2 and molecular weight 178.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯乙酰脲
N-carbamoyl-2-phenylacetamide
Also Known As: phenacemide, Phenurone, Phenylacetylurea, Phenacetylurea, Cetylureum
| Molecular Formula | C9H10N2O2 |
|---|---|
| Molecular Weight | 178.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.07423 |
| Heavy Atoms | 13 |
| Complexity | 198.0 |
| Melting Point | 215 |
| Solubility | 10.2 |
Chemical Identifiers
| CAS Number | 63-98-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)NC(=O)N |
| InChIKey | XPFRXWCVYUEORT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯乙酰脲 (CAS 63-98-9), with molecular formula C9H10N2O2 and molecular weight 178.07 g/mol. IUPAC: N-carbamoyl-2-phenylacetamide.
Chemical Property Profile of 苯乙酰脲
Property Insights of 苯乙酰脲
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯乙酰脲. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 苯乙酰脲. Following Lipinski's Rule of Five, 苯乙酰脲 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 苯乙酰脲?
The CAS number of 苯乙酰脲 is 63-98-9.
What is the molecular formula of 苯乙酰脲?
The molecular formula of 苯乙酰脲 is C9H10N2O2.
What is the molecular weight of 苯乙酰脲?
The molecular weight of 苯乙酰脲 is 178.07 g/mol.
Where can I buy 苯乙酰脲?
You can request a quote for 苯乙酰脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯乙酰脲?
Yes, KEHONG BIO provides custom synthesis services for 苯乙酰脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.