Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester
TL;DR: Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester (CAS 2580-92-9) is a chemical compound with molecular formula C13H22NO5P and molecular weight 303.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl (2-methyl-6-oxo-1-propyl-4-pyridinyl) phosphate
Also Known As: 1h-indole-7-acetic acid,2,3-dihydro-, diethyl 6-methyl-2-oxo-1-propyl-1,2-dihydropyridin-4-yl phosphate, Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester, diethyl (2-methyl-6-oxo-1-propylpyridin-4-yl) phosphate, 4-diethoxyphosphoryloxy-6-methyl-1-propyl-pyridin-2-one
| Molecular Formula | C13H22NO5P |
|---|---|
| Molecular Weight | 303.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 303.12357 |
| Heavy Atoms | 20 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 2580-92-9 |
|---|---|
| SMILES | CCCN1C(=CC(=CC1=O)OP(=O)(OCC)OCC)C |
| InChIKey | VNHDQPMJKBMAFS-UHFFFAOYSA-N |
Product Overview
Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester (CAS 2580-92-9), with molecular formula C13H22NO5P and molecular weight 303.12 g/mol. IUPAC: diethyl (2-methyl-6-oxo-1-propyl-4-pyridinyl) phosphate.
Chemical Property Profile of Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester
Property Insights of Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester. Following Lipinski's Rule of Five, Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester has 0 hydrogen bond donor(s) and 5 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 Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester?
The CAS number of Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester is 2580-92-9.
What is the molecular formula of Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester?
The molecular formula of Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester is C13H22NO5P.
What is the molecular weight of Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester?
The molecular weight of Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester is 303.12 g/mol.
Where can I buy Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester?
You can request a quote for Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, 1,2-dihydro-6-methyl-2-oxo-1-propyl-4-pyridinyl diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.