2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate
TL;DR: 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate (CAS 374091-21-1) is a chemical compound with molecular formula C13H9Cl2NO4 and molecular weight 312.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-4-oxopyran-3-yl) N-(3,4-dichlorophenyl)carbamate
Also Known As: 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate, (2-methyl-4-oxopyran-3-yl) N-(3,4-dichlorophenyl)carbamate, (3,4-Dichloro-phenyl)-carbamic acid 2-methyl-4-oxo-4H-pyran-3-yl ester, N-(3,4-dichlorophenyl)(2-methyl-4-oxopyran-3-yloxy)carboxamide, (2-methyl-4-oxidanylidene-pyran-3-yl) N-(3,4-dichlorophenyl)carbamate
| Molecular Formula | C13H9Cl2NO4 |
|---|---|
| Molecular Weight | 312.99 g/mol |
| LogP | 3.86592 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.99088 |
| Heavy Atoms | 20 |
| Complexity | 711.7576 |
Chemical Identifiers
| CAS Number | 374091-21-1 |
|---|---|
| SMILES | CC1=C(C(=O)C=CO1)OC(=O)NC2=CC(=C(C=C2)Cl)Cl |
Product Overview
2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate (CAS 374091-21-1), with molecular formula C13H9Cl2NO4 and molecular weight 312.99 g/mol. IUPAC: (2-methyl-4-oxopyran-3-yl) N-(3,4-dichlorophenyl)carbamate.
Chemical Property Profile of 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate
Property Insights of 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate
The XLogP value of 3.86592 indicates that 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate. Following Lipinski's Rule of Five, 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate 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-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate?
The CAS number of 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate is 374091-21-1.
What is the molecular formula of 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate?
The molecular formula of 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate is C13H9Cl2NO4.
What is the molecular weight of 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate?
The molecular weight of 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate is 312.99 g/mol.
Where can I buy 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate?
You can request a quote for 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-4-oxo-4H-pyran-3-yl (3,4-dichlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.