N-benzyl-2-cyanoaziridine-1-carboxamide
TL;DR: N-benzyl-2-cyanoaziridine-1-carboxamide (CAS 219501-44-7) is a chemical compound with molecular formula C11H11N3O and molecular weight 201.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-cyanoaziridine-1-carboxamide
Also Known As: N-Benzyl-2-cyanoaziridine-1-carboxamide, N-benzyl-2-cyano-aziridine-1-carboxamide, J1.081.244E, 1-Aziridinecarboxamide, 2-cyano-N-(phenylmethyl)-
| Molecular Formula | C11H11N3O |
|---|---|
| Molecular Weight | 201.09 g/mol |
| LogP | 1.10398 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.09021 |
| Heavy Atoms | 15 |
| Complexity | 396.0441 |
Chemical Identifiers
| CAS Number | 219501-44-7 |
|---|---|
| SMILES | C1C(N1C(=O)NCC2=CC=CC=C2)C#N |
Product Overview
N-benzyl-2-cyanoaziridine-1-carboxamide (CAS 219501-44-7), with molecular formula C11H11N3O and molecular weight 201.09 g/mol. IUPAC: N-benzyl-2-cyanoaziridine-1-carboxamide.
Chemical Property Profile of N-benzyl-2-cyanoaziridine-1-carboxamide
Property Insights of N-benzyl-2-cyanoaziridine-1-carboxamide
The XLogP value of 1.10398 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-2-cyanoaziridine-1-carboxamide. With a topological polar surface area (TPSA) of 55.9 Ų, N-benzyl-2-cyanoaziridine-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-2-cyanoaziridine-1-carboxamide has 1 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 N-benzyl-2-cyanoaziridine-1-carboxamide?
The CAS number of N-benzyl-2-cyanoaziridine-1-carboxamide is 219501-44-7.
What is the molecular formula of N-benzyl-2-cyanoaziridine-1-carboxamide?
The molecular formula of N-benzyl-2-cyanoaziridine-1-carboxamide is C11H11N3O.
What is the molecular weight of N-benzyl-2-cyanoaziridine-1-carboxamide?
The molecular weight of N-benzyl-2-cyanoaziridine-1-carboxamide is 201.09 g/mol.
Where can I buy N-benzyl-2-cyanoaziridine-1-carboxamide?
You can request a quote for N-benzyl-2-cyanoaziridine-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2-cyanoaziridine-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2-cyanoaziridine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.