4-Phenylsemicarbazide
TL;DR: 4-Phenylsemicarbazide (CAS 537-47-3) is a chemical compound with molecular formula C7H9N3O and molecular weight 151.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-phenylurea
Also Known As: 4-PHENYLSEMICARBAZIDE, N-Phenylhydrazinecarboxamide, 1-Amino-3-phenylurea, 3-amino-1-phenylurea, Anilinoformylhydrazine
| Molecular Formula | C7H9N3O |
|---|---|
| Molecular Weight | 151.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 151.07455 |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 537-47-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NN |
| InChIKey | MOCKWYUCPREFCZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Phenylsemicarbazide (CAS 537-47-3), with molecular formula C7H9N3O and molecular weight 151.07 g/mol. IUPAC: 1-amino-3-phenylurea.
Chemical Property Profile of 4-Phenylsemicarbazide
Property Insights of 4-Phenylsemicarbazide
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenylsemicarbazide. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Phenylsemicarbazide. Following Lipinski's Rule of Five, 4-Phenylsemicarbazide 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 4-Phenylsemicarbazide?
The CAS number of 4-Phenylsemicarbazide is 537-47-3.
What is the molecular formula of 4-Phenylsemicarbazide?
The molecular formula of 4-Phenylsemicarbazide is C7H9N3O.
What is the molecular weight of 4-Phenylsemicarbazide?
The molecular weight of 4-Phenylsemicarbazide is 151.07 g/mol.
Where can I buy 4-Phenylsemicarbazide?
You can request a quote for 4-Phenylsemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenylsemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenylsemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.