2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈
TL;DR: 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 (CAS 84095-81-8) is a chemical compound with molecular formula C15H11N3O and molecular weight 249.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈
2-benzoyl-3-(pyridin-2-ylamino)prop-2-enenitrile
Also Known As: 2-benzoyl-3-(pyridin-2-ylamino)prop-2-enenitrile, (E)-2-benzoyl-3-(pyridin-2-ylamino)prop-2-enenitrile
| Molecular Formula | C15H11N3O |
|---|---|
| Molecular Weight | 249.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.09021 |
| Heavy Atoms | 19 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 84095-81-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C(=CNC2=CC=CC=N2)C#N |
| InChIKey | IXLWVTYASHXPRT-UHFFFAOYSA-N |
Product Overview
2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 (CAS 84095-81-8), with molecular formula C15H11N3O and molecular weight 249.09 g/mol. IUPAC: 2-benzoyl-3-(pyridin-2-ylamino)prop-2-enenitrile.
Chemical Property Profile of 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈
Property Insights of 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈
The XLogP value of 3.1 indicates that 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈. Following Lipinski's Rule of Five, 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 has 1 hydrogen bond donor(s) and 4 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 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈?
The CAS number of 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 is 84095-81-8.
What is the molecular formula of 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈?
The molecular formula of 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 is C15H11N3O.
What is the molecular weight of 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈?
The molecular weight of 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 is 249.09 g/mol.
Where can I buy 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈?
You can request a quote for 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈?
Yes, KEHONG BIO provides custom synthesis services for 2-苯甲酰基-3-(吡啶-2-基氨基)丙-2-烯腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.