3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺
TL;DR: 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺 (CAS 114724-41-3) is a chemical compound with molecular formula C14H13N3O and molecular weight 239.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺
3-imino-3-phenyl-N-pyridin-2-ylpropanamide
Also Known As: NCIStruc1_000686, NCIStruc2_000687, KST-1A1847, 3-imino-3-phenyl-N-pyridin-2-ylpropanamide, 3-imino-3-phenyl-N-(2-pyridinyl)propanamide
| Molecular Formula | C14H13N3O |
|---|---|
| Molecular Weight | 239.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.10587 |
| Heavy Atoms | 18 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 114724-41-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=N)CC(=O)NC2=CC=CC=N2 |
| InChIKey | UFVYCZSSUPZFOQ-UHFFFAOYSA-N |
Product Overview
3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺 (CAS 114724-41-3), with molecular formula C14H13N3O and molecular weight 239.11 g/mol. IUPAC: 3-imino-3-phenyl-N-pyridin-2-ylpropanamide.
Chemical Property Profile of 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺
Property Insights of 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺. Following Lipinski's Rule of Five, 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺 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-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺?
The CAS number of 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺 is 114724-41-3.
What is the molecular formula of 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺?
The molecular formula of 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺 is C14H13N3O.
What is the molecular weight of 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺?
The molecular weight of 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺 is 239.11 g/mol.
Where can I buy 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺?
You can request a quote for 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺?
Yes, KEHONG BIO provides custom synthesis services for 3-亚氨基-3-苯基-N-(吡啶-2-基)丙酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.