Bayer 47416
TL;DR: Bayer 47416 (CAS 2830-86-6) is a chemical compound with molecular formula C7H15N2O5PS and molecular weight 270.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-dimethoxyphosphorylsulfanyl-N,N'-dimethylpropanediamide
Also Known As: Bayer 47416, Phosphorothioic acid, O,O-dimethyl ester, S-ester with 2-mercapto-N,N'-dimethylmalonamide, 2-dimethoxyphosphorylsulfanyl-N,N'-dimethylpropanediamide, dimethyl {[bis(methylcarbamoyl)methyl]sulfanyl}phosphonate, S-Bis(methylcarbamoyl)methyl O,O-dimethyl=phosphorothioate
| Molecular Formula | C7H15N2O5PS |
|---|---|
| Molecular Weight | 270.04 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 270.0439 |
| Heavy Atoms | 16 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 2830-86-6 |
|---|---|
| SMILES | CNC(=O)C(C(=O)NC)SP(=O)(OC)OC |
| InChIKey | SDMYKERLCMBRTM-UHFFFAOYSA-N |
Product Overview
Bayer 47416 (CAS 2830-86-6), with molecular formula C7H15N2O5PS and molecular weight 270.04 g/mol. IUPAC: 2-dimethoxyphosphorylsulfanyl-N,N'-dimethylpropanediamide.
Chemical Property Profile of Bayer 47416
Property Insights of Bayer 47416
The XLogP value of -1.2 indicates that Bayer 47416 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bayer 47416. Following Lipinski's Rule of Five, Bayer 47416 has 2 hydrogen bond donor(s) and 6 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 Bayer 47416?
The CAS number of Bayer 47416 is 2830-86-6.
What is the molecular formula of Bayer 47416?
The molecular formula of Bayer 47416 is C7H15N2O5PS.
What is the molecular weight of Bayer 47416?
The molecular weight of Bayer 47416 is 270.04 g/mol.
Where can I buy Bayer 47416?
You can request a quote for Bayer 47416 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bayer 47416?
Yes, KEHONG BIO provides custom synthesis services for Bayer 47416 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.