N-(1-Cyano-azetidin-3-ylmethyl)-benzamide
TL;DR: N-(1-Cyano-azetidin-3-ylmethyl)-benzamide (CAS 325775-41-5) is a chemical compound with molecular formula C12H13N3O and molecular weight 215.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-cyanoazetidin-3-yl)methyl]benzamide
Also Known As: N-[(1-cyanoazetidin-3-yl)methyl]benzamide, Benzamide, N-[(1-cyano-3-azetidinyl)methyl]-, N-(1-Cyano-azetidin-3-ylmethyl)-benzamide, n-[(1-cyano-3-azetidinyl)methyl]benzamide, J1.488.794F
| Molecular Formula | C12H13N3O |
|---|---|
| Molecular Weight | 215.11 g/mol |
| LogP | 0.82928 |
| Topological Polar Surface Area | 56.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.10587 |
| Heavy Atoms | 16 |
| Complexity | 404.0221 |
Chemical Identifiers
| CAS Number | 325775-41-5 |
|---|---|
| SMILES | C1C(CN1C#N)CNC(=O)C2=CC=CC=C2 |
Product Overview
N-(1-Cyano-azetidin-3-ylmethyl)-benzamide (CAS 325775-41-5), with molecular formula C12H13N3O and molecular weight 215.11 g/mol. IUPAC: N-[(1-cyanoazetidin-3-yl)methyl]benzamide.
Chemical Property Profile of N-(1-Cyano-azetidin-3-ylmethyl)-benzamide
Property Insights of N-(1-Cyano-azetidin-3-ylmethyl)-benzamide
The XLogP value of 0.82928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-Cyano-azetidin-3-ylmethyl)-benzamide. With a topological polar surface area (TPSA) of 56.13 Ų, N-(1-Cyano-azetidin-3-ylmethyl)-benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-Cyano-azetidin-3-ylmethyl)-benzamide has 1 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 N-(1-Cyano-azetidin-3-ylmethyl)-benzamide?
The CAS number of N-(1-Cyano-azetidin-3-ylmethyl)-benzamide is 325775-41-5.
What is the molecular formula of N-(1-Cyano-azetidin-3-ylmethyl)-benzamide?
The molecular formula of N-(1-Cyano-azetidin-3-ylmethyl)-benzamide is C12H13N3O.
What is the molecular weight of N-(1-Cyano-azetidin-3-ylmethyl)-benzamide?
The molecular weight of N-(1-Cyano-azetidin-3-ylmethyl)-benzamide is 215.11 g/mol.
Where can I buy N-(1-Cyano-azetidin-3-ylmethyl)-benzamide?
You can request a quote for N-(1-Cyano-azetidin-3-ylmethyl)-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-Cyano-azetidin-3-ylmethyl)-benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Cyano-azetidin-3-ylmethyl)-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.