3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione
TL;DR: 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione (CAS 100718-50-1) is a chemical compound with molecular formula C14H17NO3 and molecular weight 247.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-phenyl-5-propan-2-yl-1,3-oxazinane-2,4-dione
Also Known As: 4-27-00-03357 (Beilstein Handbook Reference), 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione, Dihydro-5-isopropyl-3-methyl-5-phenyl-2H-1,3-oxazine-2,4(3H)-dione, 2H-1,3-Oxazine-2,4(3H)-dione, dihydro-5-isopropyl-3-methyl-5-phenyl-, Diidro-5-isopropil-3-metil-5-fenil-2H-1,3-ossazin-2,4(3H)-dione [Italian]
| Molecular Formula | C14H17NO3 |
|---|---|
| Molecular Weight | 247.12 g/mol |
| LogP | 2.189 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.12085 |
| Heavy Atoms | 18 |
| Complexity | 469.18726 |
Chemical Identifiers
| CAS Number | 100718-50-1 |
|---|---|
| SMILES | CC(C)C1(COC(=O)N(C1=O)C)C2=CC=CC=C2 |
Product Overview
3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione (CAS 100718-50-1), with molecular formula C14H17NO3 and molecular weight 247.12 g/mol. IUPAC: 3-methyl-5-phenyl-5-propan-2-yl-1,3-oxazinane-2,4-dione.
Chemical Property Profile of 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione
Property Insights of 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione
The XLogP value of 2.189 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione. With a topological polar surface area (TPSA) of 46.61 Ų, 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione 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 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione?
The CAS number of 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione is 100718-50-1.
What is the molecular formula of 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione?
The molecular formula of 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione is C14H17NO3.
What is the molecular weight of 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione?
The molecular weight of 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione is 247.12 g/mol.
Where can I buy 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione?
You can request a quote for 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-5-phenyl-5-(propan-2-yl)-1,3-oxazinane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.