![tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate structure](/static/products/116/1164543-32-1.png)
tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate
TL;DR: tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate (CAS 1164543-32-1) is a chemical compound with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(2-hydroxy-1-prop-2-enylindol-3-yl)iminocarbamate
Also Known As: tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate, (Z)-tert-butyl 2-(1-allyl-2-oxoindolin-3-ylidene)hydrazinecarboxylate, tert-butyl N-[(E)-(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate, tert-butyl N-[(Z)-(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate, N'-[1-Allyl-2-oxo-1,2-dihydro-indol-(3Z)-ylidene]-hydrazinecarboxylic acid tert-butyl ester
| Molecular Formula | C16H19N3O3 |
|---|---|
| Molecular Weight | 301.14 g/mol |
| LogP | 4.5517 |
| Topological Polar Surface Area | 76.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.14264 |
| Heavy Atoms | 22 |
| Complexity | 738.90936 |
Chemical Identifiers
| CAS Number | 1164543-32-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N=NC1=C(N(C2=CC=CC=C21)CC=C)O |
Product Overview
tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate (CAS 1164543-32-1), with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol. IUPAC: tert-butyl N-(2-hydroxy-1-prop-2-enylindol-3-yl)iminocarbamate.
Chemical Property Profile of tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate
Property Insights of tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate
The XLogP value of 4.5517 indicates that tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.18 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate has 1 hydrogen bond donor(s) and 4 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 N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate?
The CAS number of tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate is 1164543-32-1.
What is the molecular formula of tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate?
The molecular formula of tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate is C16H19N3O3.
What is the molecular weight of tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate?
The molecular weight of tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate is 301.14 g/mol.
Where can I buy tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate?
You can request a quote for tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]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 N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[(2-oxo-1-prop-2-enylindol-3-ylidene)amino]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.