Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester
TL;DR: Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester (CAS 33895-62-4) is a chemical compound with molecular formula C14H21N2O4P and molecular weight 312.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-diethoxyphosphoryl-3-(4-methylphenyl)aziridine-2-carboxamide
Also Known As: [3-2- aziridin-2-yl]phosphonicaciddiethylester|[3- -2- aziridin-2-yl]phosphonicaciddiethylester|Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester|3-diethoxyphosphoryl-3-(4-methylphenyl)aziridine-2-carboxamide|diethyl [3-carbamoyl-2-(4-methylphenyl)aziridin-2-yl]phosphonate|diethyl[3-carbamoyl-2-(4-methylphenyl)aziridin-2-yl]phosphonate|Phosphonic acid, [3-(aminocarbonyl)-2-(4-methylphenyl)-2-aziridinyl]-, diethyl ester|Diethyl 3-(aminocarbonyl)-2-(4-methylphenyl)-2-aziridinylphosphonate #|[3-(Aminocarbonyl)-2-(4-methylphenyl)aziridin-2-yl]phosphonic acid diethyl ester|KXXFEMLWJVKBLT-UHFFFAOYSA-N
| Molecular Formula | C14H21N2O4P |
|---|---|
| Molecular Weight | 312.12 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 312.1239 |
| Heavy Atoms | 21 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 33895-62-4 |
|---|---|
| SMILES | CCOP(=O)(C1(C(N1)C(=O)N)C2=CC=C(C=C2)C)OCC |
| InChIKey | KXXFEMLWJVKBLT-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester (CAS 33895-62-4), with molecular formula C14H21N2O4P and molecular weight 312.12 g/mol. IUPAC: 3-diethoxyphosphoryl-3-(4-methylphenyl)aziridine-2-carboxamide.
Chemical Property Profile of Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester
Property Insights of Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester. Following Lipinski's Rule of Five, Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester has 2 hydrogen bond donor(s) and 5 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 Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester?
The CAS number of Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester is 33895-62-4.
What is the molecular formula of Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester?
The molecular formula of Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester is C14H21N2O4P.
What is the molecular weight of Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester?
The molecular weight of Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester is 312.12 g/mol.
Where can I buy Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester?
You can request a quote for Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (3-carbamoyl-2-p-tolyl-2-aziridinyl)-, diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.