Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea
TL;DR: Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea (CAS 2425-16-3) is a chemical compound with molecular formula C7H15N2O4PS2 and molecular weight 286.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-carbamoyl-2-diethoxyphosphinothioylsulfanylacetamide
Also Known As: 4-03-00-00629 (Beilstein Handbook Reference), Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea, Urea, mercaptoacetyl-, S-ester with O,O-diethyl phosphorodithioate, N-carbamoyl-2-diethoxyphosphinothioylsulfanylacetamide, Phosphorodithioic acid, S-(2-((aminocarbonyl)amino)-2-oxoethyl) O,O-diethyl ester
| Molecular Formula | C7H15N2O4PS2 |
|---|---|
| Molecular Weight | 286.02 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 286.0211 |
| Heavy Atoms | 16 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 2425-16-3 |
|---|---|
| SMILES | CCOP(=S)(OCC)SCC(=O)NC(=O)N |
| InChIKey | XYKRSZGFPADKEN-UHFFFAOYSA-N |
Product Overview
Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea (CAS 2425-16-3), with molecular formula C7H15N2O4PS2 and molecular weight 286.02 g/mol. IUPAC: N-carbamoyl-2-diethoxyphosphinothioylsulfanylacetamide.
Chemical Property Profile of Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea
Property Insights of Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea. The TPSA of 148.0 Ų indicates high polarity, suggesting Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea 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 Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea?
The CAS number of Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea is 2425-16-3.
What is the molecular formula of Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea?
The molecular formula of Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea is C7H15N2O4PS2.
What is the molecular weight of Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea?
The molecular weight of Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea is 286.02 g/mol.
Where can I buy Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea?
You can request a quote for Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodithioic acid, O,O-diethyl ester, S-ester with (mercaptoacetyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.