(S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate
TL;DR: (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate (CAS 1173671-89-0) is a chemical compound with molecular formula C17H21N5O3 and molecular weight 343.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2S)-1-oxo-1-[(2E)-2-(quinoxalin-5-ylmethylidene)hydrazinyl]propan-2-yl]carbamate
Also Known As: (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate, {(S)-1-[1-Quinoxalin-5-yl-meth-(E)-ylidene-hydrazinocarbonyl]-ethyl}-carbamic acid tert-butyl ester, tert-butyl {(2S)-1-oxo-1-[(2E)-2-(quinoxalin-5-ylmethylidene)hydrazinyl]propan-2-yl}carbamate (non-preferred name)
| Molecular Formula | C17H21N5O3 |
|---|---|
| Molecular Weight | 343.16 g/mol |
| LogP | 1.9931 |
| Topological Polar Surface Area | 105.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.16443 |
| Heavy Atoms | 25 |
| Complexity | 792.965 |
Chemical Identifiers
| CAS Number | 1173671-89-0 |
|---|---|
| SMILES | C[C@@H](C(=O)N/N=C/C1=C2C(=CC=C1)N=CC=N2)NC(=O)OC(C)(C)C |
Product Overview
(S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate (CAS 1173671-89-0), with molecular formula C17H21N5O3 and molecular weight 343.16 g/mol. IUPAC: tert-butyl N-[(2S)-1-oxo-1-[(2E)-2-(quinoxalin-5-ylmethylidene)hydrazinyl]propan-2-yl]carbamate.
Chemical Property Profile of (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate
Property Insights of (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate
The XLogP value of 1.9931 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate. The TPSA of 105.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate. Following Lipinski's Rule of Five, (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate has 2 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 (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
The CAS number of (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate is 1173671-89-0.
What is the molecular formula of (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
The molecular formula of (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate is C17H21N5O3.
What is the molecular weight of (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
The molecular weight of (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate is 343.16 g/mol.
Where can I buy (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
You can request a quote for (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-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 (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for (S,E)-tert-butyl (1-oxo-1-(2-(quinoxalin-5-ylmethylene)hydrazinyl)propan-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.