(E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate
TL;DR: (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate (CAS 369394-77-4) is a chemical compound with molecular formula C14H14N4O3 and molecular weight 286.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[1-(3-cyanopropyl)-2-hydroxyindol-3-yl]iminocarbamate
Also Known As: (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate, methyl (2E)-2-[1-(3-cyanopropyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinecarboxylate, methyl N-[[1-(3-cyanopropyl)-2-oxoindol-3-ylidene]amino]carbamate, methyl N-[(E)-[1-(3-cyanopropyl)-2-oxoindol-3-ylidene]amino]carbamate, methyl N-[(Z)-[1-(3-cyanopropyl)-2-oxoindol-3-ylidene]amino]carbamate
| Molecular Formula | C14H14N4O3 |
|---|---|
| Molecular Weight | 286.11 g/mol |
| LogP | 3.50078 |
| Topological Polar Surface Area | 99.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.1066 |
| Heavy Atoms | 21 |
| Complexity | 727.6297 |
Chemical Identifiers
| CAS Number | 369394-77-4 |
|---|---|
| SMILES | COC(=O)N=NC1=C(N(C2=CC=CC=C21)CCCC#N)O |
Product Overview
(E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate (CAS 369394-77-4), with molecular formula C14H14N4O3 and molecular weight 286.11 g/mol. IUPAC: methyl N-[1-(3-cyanopropyl)-2-hydroxyindol-3-yl]iminocarbamate.
Chemical Property Profile of (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate
Property Insights of (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate
The XLogP value of 3.50078 indicates that (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.97 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate. Following Lipinski's Rule of Five, (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate has 1 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 (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate?
The CAS number of (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate is 369394-77-4.
What is the molecular formula of (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate?
The molecular formula of (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate is C14H14N4O3.
What is the molecular weight of (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate?
The molecular weight of (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate is 286.11 g/mol.
Where can I buy (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate?
You can request a quote for (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 2-(1-(3-cyanopropyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.