![2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE structure](/static/products/3314/331454-85-4.webp)
2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE
TL;DR: 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE (CAS 331454-85-4) is a chemical compound with molecular formula C21H18N6O and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridin-3-ylmethylamino)-3-(pyridin-3-ylmethyliminomethyl)pyrido[1,2-a]pyrimidin-4-one
Also Known As: 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE, 2-(3-pyridylmethylamino)-3-[(Z)-3-pyridylmethyliminomethyl]pyrido[1,2-a]pyrimidin-4-one, 2-(pyridin-3-ylmethylamino)-3-(pyridin-3-ylmethyliminomethyl)pyrido[1,2-a]pyrimidin-4-one, (E)-2-((pyridin-3-ylmethyl)amino)-3-(((pyridin-3-ylmethyl)imino)methyl)-4H-pyrido[1,2-a]pyrimidin-4-one, 2-((3-Pyridinylmethyl)amino)-3-((E)-(((E)-3-pyridinylmethyl)imino)methyl)-4H-pyrido(1,2-A)pyrimidin-4-one
| Molecular Formula | C21H18N6O |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 2.7157 |
| Topological Polar Surface Area | 84.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.1542 |
| Heavy Atoms | 28 |
| Complexity | 1155.8545 |
Chemical Identifiers
| CAS Number | 331454-85-4 |
|---|---|
| SMILES | C1=CC2=NC(=C(C(=O)N2C=C1)C=NCC3=CN=CC=C3)NCC4=CN=CC=C4 |
Product Overview
2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE (CAS 331454-85-4), with molecular formula C21H18N6O and molecular weight 370.15 g/mol. IUPAC: 2-(pyridin-3-ylmethylamino)-3-(pyridin-3-ylmethyliminomethyl)pyrido[1,2-a]pyrimidin-4-one.
Chemical Property Profile of 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE
Property Insights of 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE
The XLogP value of 2.7157 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE. The TPSA of 84.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE. Following Lipinski's Rule of Five, 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE has 1 hydrogen bond donor(s) and 6 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-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?
The CAS number of 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE is 331454-85-4.
What is the molecular formula of 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?
The molecular formula of 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE is C21H18N6O.
What is the molecular weight of 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?
The molecular weight of 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE is 370.15 g/mol.
Where can I buy 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?
You can request a quote for 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-PYRIDINYLMETHYL)AMINO]-3-((E)-{[(E)-3-PYRIDINYLMETHYL]IMINO}METHYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.