3-amino-N-phenyl-2H-azirene-2-carboxamide
TL;DR: 3-amino-N-phenyl-2H-azirene-2-carboxamide (CAS 94744-44-2) is a chemical compound with molecular formula C9H9N3O and molecular weight 175.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-N-phenyl-2H-azirine-2-carboxamide
Also Known As: ChemDiv2_002513, 3-amino-N-phenyl-2H-azirene-2-carboxamide, 3-amino-N-phenyl-2H-azirine-2-carboxamide, 3-amino-2-phenylcarbamoyl-2h-azirine, (3-amino(2H-azirin-2-yl))-N-benzamide
| Molecular Formula | C9H9N3O |
|---|---|
| Molecular Weight | 175.07 g/mol |
| LogP | 0.3645 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.07455 |
| Heavy Atoms | 13 |
| Complexity | 358.3824 |
Chemical Identifiers
| CAS Number | 94744-44-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)C2C(=N2)N |
Product Overview
3-amino-N-phenyl-2H-azirene-2-carboxamide (CAS 94744-44-2), with molecular formula C9H9N3O and molecular weight 175.07 g/mol. IUPAC: 3-amino-N-phenyl-2H-azirine-2-carboxamide.
Chemical Property Profile of 3-amino-N-phenyl-2H-azirene-2-carboxamide
Property Insights of 3-amino-N-phenyl-2H-azirene-2-carboxamide
The XLogP value of 0.3645 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-N-phenyl-2H-azirene-2-carboxamide. The TPSA of 67.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-N-phenyl-2H-azirene-2-carboxamide. Following Lipinski's Rule of Five, 3-amino-N-phenyl-2H-azirene-2-carboxamide 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 3-amino-N-phenyl-2H-azirene-2-carboxamide?
The CAS number of 3-amino-N-phenyl-2H-azirene-2-carboxamide is 94744-44-2.
What is the molecular formula of 3-amino-N-phenyl-2H-azirene-2-carboxamide?
The molecular formula of 3-amino-N-phenyl-2H-azirene-2-carboxamide is C9H9N3O.
What is the molecular weight of 3-amino-N-phenyl-2H-azirene-2-carboxamide?
The molecular weight of 3-amino-N-phenyl-2H-azirene-2-carboxamide is 175.07 g/mol.
Where can I buy 3-amino-N-phenyl-2H-azirene-2-carboxamide?
You can request a quote for 3-amino-N-phenyl-2H-azirene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-N-phenyl-2H-azirene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-N-phenyl-2H-azirene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.