O,O-DIALLYL DITHIOPHOSPHATE
TL;DR: O,O-DIALLYL DITHIOPHOSPHATE (CAS 360062-30-2) is a chemical compound with molecular formula C17H18N4O2 and molecular weight 310.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-cyano-3-(dimethylaminomethylideneamino)-5-methyl-1-phenylpyrrole-2-carboxylate
Also Known As: O,O-DIALLYL DITHIOPHOSPHATE, BIM-0035302.P001, Di(prop-2-enoxy)-sulfanyl-sulfanylidene-lambda5-phosphane, methyl 4-cyano-3-(dimethylaminomethylideneamino)-5-methyl-1-phenylpyrrole-2-carboxylate, (E)-methyl 4-cyano-3-(((dimethylamino)methylene)amino)-5-methyl-1-phenyl-1H-pyrrole-2-carboxylate
| Molecular Formula | C17H18N4O2 |
|---|---|
| Molecular Weight | 310.14 g/mol |
| LogP | 2.6654 |
| Topological Polar Surface Area | 70.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.14297 |
| Heavy Atoms | 23 |
| Complexity | 783.1601 |
Chemical Identifiers
| CAS Number | 360062-30-2 |
|---|---|
| SMILES | CC1=C(C(=C(N1C2=CC=CC=C2)C(=O)OC)N=CN(C)C)C#N |
Product Overview
O,O-DIALLYL DITHIOPHOSPHATE (CAS 360062-30-2), with molecular formula C17H18N4O2 and molecular weight 310.14 g/mol. IUPAC: methyl 4-cyano-3-(dimethylaminomethylideneamino)-5-methyl-1-phenylpyrrole-2-carboxylate.
Chemical Property Profile of O,O-DIALLYL DITHIOPHOSPHATE
Property Insights of O,O-DIALLYL DITHIOPHOSPHATE
The XLogP value of 2.6654 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O,O-DIALLYL DITHIOPHOSPHATE. The TPSA of 70.62 Ų falls within the moderate polarity range, balancing permeability and solubility for O,O-DIALLYL DITHIOPHOSPHATE. Following Lipinski's Rule of Five, O,O-DIALLYL DITHIOPHOSPHATE has 0 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 O,O-DIALLYL DITHIOPHOSPHATE?
The CAS number of O,O-DIALLYL DITHIOPHOSPHATE is 360062-30-2.
What is the molecular formula of O,O-DIALLYL DITHIOPHOSPHATE?
The molecular formula of O,O-DIALLYL DITHIOPHOSPHATE is C17H18N4O2.
What is the molecular weight of O,O-DIALLYL DITHIOPHOSPHATE?
The molecular weight of O,O-DIALLYL DITHIOPHOSPHATE is 310.14 g/mol.
Where can I buy O,O-DIALLYL DITHIOPHOSPHATE?
You can request a quote for O,O-DIALLYL DITHIOPHOSPHATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,O-DIALLYL DITHIOPHOSPHATE?
Yes, KEHONG BIO provides custom synthesis services for O,O-DIALLYL DITHIOPHOSPHATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.