2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone
TL;DR: 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone (CAS 77280-56-9) is a chemical compound with molecular formula C16H22N4O7 and molecular weight 382.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-(aziridin-1-yl)-4-(ethoxycarbonylamino)-5-(2-hydroxyethylamino)-3,6-dioxocyclohexa-1,4-dien-1-yl]carbamate
Also Known As: Azqmaa, Azq monoaminoalcohol, 2-aziridinyl-5-3,5-bis -1,4-benzoquinone, ethyl N-[2-(aziridin-1-yl)-4-(ethoxycarbonylamino)-5-(2-hydroxyethylamino)-3,6-dioxocyclohexa-1,4-dien-1-yl]carbamate, 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone
| Molecular Formula | C16H22N4O7 |
|---|---|
| Molecular Weight | 382.15 g/mol |
| LogP | -1.0489 |
| Topological Polar Surface Area | 146.07 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 382.14883 |
| Heavy Atoms | 27 |
| Complexity | 709.5574 |
Chemical Identifiers
| CAS Number | 77280-56-9 |
|---|---|
| SMILES | CCOC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)OCC)NCCO |
Product Overview
2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone (CAS 77280-56-9), with molecular formula C16H22N4O7 and molecular weight 382.15 g/mol. IUPAC: ethyl N-[2-(aziridin-1-yl)-4-(ethoxycarbonylamino)-5-(2-hydroxyethylamino)-3,6-dioxocyclohexa-1,4-dien-1-yl]carbamate.
Chemical Property Profile of 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone
Property Insights of 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone
The XLogP value of -1.0489 indicates that 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.07 Ų indicates high polarity, suggesting 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone has 4 hydrogen bond donor(s) and 9 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 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone?
The CAS number of 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone is 77280-56-9.
What is the molecular formula of 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone?
The molecular formula of 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone is C16H22N4O7.
What is the molecular weight of 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone?
The molecular weight of 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone is 382.15 g/mol.
Where can I buy 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone?
You can request a quote for 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone?
Yes, KEHONG BIO provides custom synthesis services for 2-Aziridinyl-5-(2-hydroxyethylamino)-3,5-bis(carboethoxyamino)-1,4-benzoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.