2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-
TL;DR: 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- (CAS 27042-79-1) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylphenyl)-5-(prop-2-ynoxymethyl)-1,3-oxazolidin-2-one
Also Known As: 3- -5-[ methyl]-2-oxazolidinone, 5-(2-Propynyloxymethyl)-3-(o-tolyl)-2-oxazolidinone, 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-, 3-(2-methylphenyl)-5-(prop-2-ynoxymethyl)-1,3-oxazolidin-2-one, 3-(2-methylphenyl)-5-[(prop-2-yn-1-yloxy)methyl]-1,3-oxazolidin-2-one
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 27042-79-1 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CC(OC2=O)COCC#C |
| InChIKey | MIEHHDXFEDRRRW-UHFFFAOYSA-N |
Product Overview
2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- (CAS 27042-79-1), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: 3-(2-methylphenyl)-5-(prop-2-ynoxymethyl)-1,3-oxazolidin-2-one.
Chemical Property Profile of 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-
Property Insights of 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-. With a topological polar surface area (TPSA) of 38.8 Ų, 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- has 0 hydrogen bond donor(s) and 3 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-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-?
The CAS number of 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- is 27042-79-1.
What is the molecular formula of 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-?
The molecular formula of 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- is C14H15NO3.
What is the molecular weight of 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-?
The molecular weight of 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- is 245.11 g/mol.
Where can I buy 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-?
You can request a quote for 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxazolidinone, 5-(2-propynyloxymethyl)-3-(o-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.