methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5
TL;DR: methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 (CAS 68464-31-3) is a chemical compound with molecular formula C21H25N2O3P and molecular weight 384.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5λ5-phosphabicyclo[3.2.0]heptane-3-carboxylate
Also Known As: methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5, Methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5lambda~5~-phosphabicyclo[3.2.0]heptane-3-carboxylate, methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5lambda5-phos, methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5$l^{5}-phosphabicyclo[3.2.0]heptane-3-carboxylate, Methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5lambda5-phosphabicyclo[3.2.0]heptane-3-carboxylate
| Molecular Formula | C21H25N2O3P |
|---|---|
| Molecular Weight | 384.16 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.16028 |
| Heavy Atoms | 27 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 68464-31-3 |
|---|---|
| SMILES | CN1C(=O)N2P1(CC(C2(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC)(C)C |
| InChIKey | STNGTAMSOBPAQR-UHFFFAOYSA-N |
Product Overview
methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 (CAS 68464-31-3), with molecular formula C21H25N2O3P and molecular weight 384.16 g/mol. IUPAC: methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5λ5-phosphabicyclo[3.2.0]heptane-3-carboxylate.
Chemical Property Profile of methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5
Property Insights of methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5. With a topological polar surface area (TPSA) of 49.9 Ų, methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 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 methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5?
The CAS number of methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 is 68464-31-3.
What is the molecular formula of methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5?
The molecular formula of methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 is C21H25N2O3P.
What is the molecular weight of methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5?
The molecular weight of methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 is 384.16 g/mol.
Where can I buy methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5?
You can request a quote for methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5?
Yes, KEHONG BIO provides custom synthesis services for methyl 5,5,6-trimethyl-7-oxo-2,2-diphenyl-1,6-diaza-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.