((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester
TL;DR: ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester (CAS 16757-55-4) is a chemical compound with molecular formula C8H17N4O7P and molecular weight 312.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[(ethoxycarbonylamino)-(hydroxymethoxycarbamoylamino)phosphanyl]carbamate
Also Known As: ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester, CARBAMIC ACID, ((3-METHOXYUREIDO)PHOSPHINYLIDENE)DI-, DIETHYL ESTER, ethyl N-[(ethoxycarbonylamino)-(hydroxymethoxycarbamoylamino)phosphanyl]carbamate, BRN 3001561
| Molecular Formula | C8H17N4O7P |
|---|---|
| Molecular Weight | 312.08 g/mol |
| LogP | -0.1139 |
| Topological Polar Surface Area | 147.25 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 312.0835 |
| Heavy Atoms | 20 |
| Complexity | 309.94724 |
Chemical Identifiers
| CAS Number | 16757-55-4 |
|---|---|
| SMILES | CCOC(=O)NP(NC(=O)NOCO)NC(=O)OCC |
Product Overview
((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester (CAS 16757-55-4), with molecular formula C8H17N4O7P and molecular weight 312.08 g/mol. IUPAC: ethyl N-[(ethoxycarbonylamino)-(hydroxymethoxycarbamoylamino)phosphanyl]carbamate.
Chemical Property Profile of ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester
Property Insights of ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester
The XLogP value of -0.1139 indicates that ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.25 Ų indicates high polarity, suggesting ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester has 5 hydrogen bond donor(s) and 7 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 ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester?
The CAS number of ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester is 16757-55-4.
What is the molecular formula of ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester?
The molecular formula of ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester is C8H17N4O7P.
What is the molecular weight of ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester?
The molecular weight of ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester is 312.08 g/mol.
Where can I buy ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester?
You can request a quote for ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for ((3-Methoxyureido)phosphinylidene)dicarbamic acid diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.