2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1)
TL;DR: 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) (CAS 969-00-6) is a chemical compound with molecular formula C18H20N2O7 and molecular weight 376.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-2,3-dihydroxybutanedioic acid;2-methyl-1,2-dipyridin-3-ylpropan-1-one
Also Known As: Metyrapone tartrate, Metopirone tartrate, Metopirone ditartrate, Metyrapone ditartrate, Metyprapone bitartrate
| Molecular Formula | C18H20N2O7 |
|---|---|
| Molecular Weight | 376.13 g/mol |
| LogP | 0.51 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.12704 |
| Heavy Atoms | 27 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 969-00-6 |
|---|---|
| SMILES | CC(C)(C1=CN=CC=C1)C(=O)C2=CN=CC=C2.[C@@H](C(C(=O)O)O)(C(=O)O)O |
| InChIKey | LHWDMZWPKSLALX-VPDQHXPOSA-N |
Product Overview
2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) (CAS 969-00-6), with molecular formula C18H20N2O7 and molecular weight 376.13 g/mol. IUPAC: (3R)-2,3-dihydroxybutanedioic acid;2-methyl-1,2-dipyridin-3-ylpropan-1-one.
Chemical Property Profile of 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1)
Property Insights of 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1)
The XLogP value of 0.51 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1). The TPSA of 158.0 Ų indicates high polarity, suggesting 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) has 4 hydrogen bond donor(s) and 9 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-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1)?
The CAS number of 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) is 969-00-6.
What is the molecular formula of 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1)?
The molecular formula of 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) is C18H20N2O7.
What is the molecular weight of 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1)?
The molecular weight of 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) is 376.13 g/mol.
Where can I buy 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1)?
You can request a quote for 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydroxybutanedioic acid--2-methyl-1,2-di(pyridin-3-yl)propan-1-one (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.