(S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate
TL;DR: (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate (CAS 1014046-64-0) is a chemical compound with molecular formula C25H26N6O3 and molecular weight 458.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-[(2E)-2-(quinoxalin-6-ylmethylidene)hydrazinyl]propan-2-yl]carbamate
Also Known As: (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate, tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-[(2E)-2-(quinoxalin-6-ylmethylidene)hydrazinyl]propan-2-yl]carbamate
| Molecular Formula | C25H26N6O3 |
|---|---|
| Molecular Weight | 458.21 g/mol |
| LogP | 3.6972 |
| Topological Polar Surface Area | 121.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.20663 |
| Heavy Atoms | 34 |
| Complexity | 1355.5394 |
Chemical Identifiers
| CAS Number | 1014046-64-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N/N=C/C3=CC4=NC=CN=C4C=C3 |
Product Overview
(S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate (CAS 1014046-64-0), with molecular formula C25H26N6O3 and molecular weight 458.21 g/mol. IUPAC: tert-butyl N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-[(2E)-2-(quinoxalin-6-ylmethylidene)hydrazinyl]propan-2-yl]carbamate.
Chemical Property Profile of (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate
Property Insights of (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate
The XLogP value of 3.6972 indicates that (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.36 Ų falls within the moderate polarity range, balancing permeability and solubility for (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate. Following Lipinski's Rule of Five, (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate has 3 hydrogen bond donor(s) and 6 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 (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
The CAS number of (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate is 1014046-64-0.
What is the molecular formula of (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
The molecular formula of (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate is C25H26N6O3.
What is the molecular weight of (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
The molecular weight of (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate is 458.21 g/mol.
Where can I buy (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
You can request a quote for (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-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 (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for (S,E)-tert-butyl (3-(1H-indol-3-yl)-1-oxo-1-(2-(quinoxalin-6-ylmethylene)hydrazinyl)propan-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.