[2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate
TL;DR: [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate (CAS 730245-08-6) is a chemical compound with molecular formula C15H18N2O5 and molecular weight 306.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate
Also Known As: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate|SR-01000041001-1|2-[(TERT-BUTYLCARBAMOYL)AMINO]-2-OXOETHYL 4-FORMYLBENZOATE
| Molecular Formula | C15H18N2O5 |
|---|---|
| Molecular Weight | 306.12 g/mol |
| LogP | 1.2802 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.12158 |
| Heavy Atoms | 22 |
| Complexity | 572.59076 |
Chemical Identifiers
| CAS Number | 730245-08-6 |
|---|---|
| SMILES | CC(C)(C)NC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)C=O |
Product Overview
[2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate (CAS 730245-08-6), with molecular formula C15H18N2O5 and molecular weight 306.12 g/mol. IUPAC: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate.
Chemical Property Profile of [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate
Property Insights of [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate
The XLogP value of 1.2802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate. Following Lipinski's Rule of Five, [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate 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 [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate?
The CAS number of [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate is 730245-08-6.
What is the molecular formula of [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate?
The molecular formula of [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate is C15H18N2O5.
What is the molecular weight of [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate?
The molecular weight of [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate is 306.12 g/mol.
Where can I buy [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate?
You can request a quote for [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(Tert-butylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.