4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol
TL;DR: 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol (CAS 16638-85-0) is a chemical compound with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,6S)-4,5-dimethyl-6-phenyl-1,3,4-oxadiazinan-2-one
Also Known As: 2H-1,3,4-Oxadiazin-2-one, tetrahydro-4,5-dimethyl-6-phenyl-, cis-(-)-, 4,5-dimethyl-6-phenyl-1,3,4-oxadiazinan-2-one, 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol, cis-(-)-3,4,5,6-Tetrahydro-4,5-dimethyl-6-phenyl-2H-1,3,4-oxadiazin-2-one, (5R,6S)-4,5-dimethyl-6-phenyl-1,3,4-oxadiazinan-2-one
| Molecular Formula | C11H14N2O2 |
|---|---|
| Molecular Weight | 206.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.10553 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 16638-85-0 |
|---|---|
| SMILES | C[C@@H]1[C@@H](OC(=O)NN1C)C2=CC=CC=C2 |
| InChIKey | UXVSYSJHNUGVCD-PSASIEDQSA-N |
Product Overview
4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol (CAS 16638-85-0), with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol. IUPAC: (5R,6S)-4,5-dimethyl-6-phenyl-1,3,4-oxadiazinan-2-one.
Chemical Property Profile of 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol
Property Insights of 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol. With a topological polar surface area (TPSA) of 41.6 Ų, 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol has 1 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 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol?
The CAS number of 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol is 16638-85-0.
What is the molecular formula of 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol?
The molecular formula of 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol is C11H14N2O2.
What is the molecular weight of 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol?
The molecular weight of 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol is 206.11 g/mol.
Where can I buy 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol?
You can request a quote for 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethyl-6-phenyl-5,6-dihydro-4H-1,3,4-oxadiazin-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.