Levomecol
TL;DR: Levomecol (CAS 118573-58-3) is a chemical compound with molecular formula C16H18Cl2N4O7 and molecular weight 448.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide;5-methyl-1H-pyrimidine-2,4-dione
Also Known As: Levomecol, 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide;5-methyl-1H-pyrimidine-2,4-dione, (R-(R*,R*))-2,2-Dichloro-N-(2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl)acetamide, Acetamide, 2,2-dichloro-N-(2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl)-, (R-(R*,R*))-, mixt. with 5-methyl-2,4(1H,3H)-pyrimidinedione, 2,2-Dichloro-N-((1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl)acetamide compound with 5-methylpyrimidine-2,4(1H,3H)-dione (1:1)
| Molecular Formula | C16H18Cl2N4O7 |
|---|---|
| Molecular Weight | 448.06 g/mol |
| LogP | 0.28062 |
| Topological Polar Surface Area | 178.42 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.05527 |
| Heavy Atoms | 29 |
| Complexity | 943.2747 |
Chemical Identifiers
| CAS Number | 118573-58-3 |
|---|---|
| SMILES | CC1=CNC(=O)NC1=O.C1=CC(=CC=C1[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-] |
Product Overview
Levomecol (CAS 118573-58-3), with molecular formula C16H18Cl2N4O7 and molecular weight 448.06 g/mol. IUPAC: 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide;5-methyl-1H-pyrimidine-2,4-dione.
Chemical Property Profile of Levomecol
Property Insights of Levomecol
The XLogP value of 0.28062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Levomecol. The TPSA of 178.42 Ų indicates high polarity, suggesting Levomecol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Levomecol has 5 hydrogen bond donor(s) and 7 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 Levomecol?
The CAS number of Levomecol is 118573-58-3.
What is the molecular formula of Levomecol?
The molecular formula of Levomecol is C16H18Cl2N4O7.
What is the molecular weight of Levomecol?
The molecular weight of Levomecol is 448.06 g/mol.
Where can I buy Levomecol?
You can request a quote for Levomecol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Levomecol?
Yes, KEHONG BIO provides custom synthesis services for Levomecol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.