Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate
TL;DR: Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate (CAS 1352083-14-7) is a chemical compound with molecular formula C14H19IN2O3 and molecular weight 390.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[1-(4-iodoanilino)-1-oxopropan-2-yl]carbamate
Also Known As: tert-butyl N-[1-(4-iodoanilino)-1-oxopropan-2-yl]carbamate, tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate, tert-butyl N-[(2R)-1-(4-iodoanilino)-1-oxopropan-2-yl]carbamate
| Molecular Formula | C14H19IN2O3 |
|---|---|
| Molecular Weight | 390.04 g/mol |
| LogP | 3.1429 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.04404 |
| Heavy Atoms | 20 |
| Complexity | 480.18753 |
Chemical Identifiers
| CAS Number | 1352083-14-7 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=C(C=C1)I)NC(=O)OC(C)(C)C |
Product Overview
Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate (CAS 1352083-14-7), with molecular formula C14H19IN2O3 and molecular weight 390.04 g/mol. IUPAC: tert-butyl N-[1-(4-iodoanilino)-1-oxopropan-2-yl]carbamate.
Chemical Property Profile of Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate
Property Insights of Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate
The XLogP value of 3.1429 indicates that Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate. Following Lipinski's Rule of Five, Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate has 2 hydrogen bond donor(s) and 3 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 Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate?
The CAS number of Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate is 1352083-14-7.
What is the molecular formula of Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate?
The molecular formula of Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate is C14H19IN2O3.
What is the molecular weight of Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate?
The molecular weight of Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate is 390.04 g/mol.
Where can I buy Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate?
You can request a quote for Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl {1-[(4-iodophenyl)amino]-1-oxopropan-2-yl}carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.