PubChem SID: 26667032
TL;DR: PubChem SID: 26667032 (CAS 587006-27-7) is a chemical compound with molecular formula C21H27N3O5 and molecular weight 401.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[6-oxo-6-[(2E)-2-[(4-oxochromen-3-yl)methylidene]hydrazinyl]hexyl]carbamate
Also Known As: PubChem SID: 26667032, tert-butyl N-[6-oxo-6-[(2E)-2-[(4-oxochromen-3-yl)methylidene]hydrazinyl]hexyl]carbamate, (E)-tert-butyl (6-oxo-6-(2-((4-oxo-4H-chromen-3-yl)methylene)hydrazinyl)hexyl)carbamate, tert-butyl N-[6-oxo-6-[(2E)-2-[(4-oxochromen-3-yl)methylene]hydrazino]hexyl]carbamate, {5-[1-(4-Oxo-4H-chromen-3-yl)-meth-(E)-ylidene-hydrazinocarbonyl]-pentyl}-carbamic acid tert-butyl ester
| Molecular Formula | C21H27N3O5 |
|---|---|
| Molecular Weight | 401.20 g/mol |
| LogP | 3.3282 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 401.19507 |
| Heavy Atoms | 29 |
| Complexity | 927.7939 |
Chemical Identifiers
| CAS Number | 587006-27-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCCCCC(=O)N/N=C/C1=COC2=CC=CC=C2C1=O |
Product Overview
PubChem SID: 26667032 (CAS 587006-27-7), with molecular formula C21H27N3O5 and molecular weight 401.20 g/mol. IUPAC: tert-butyl N-[6-oxo-6-[(2E)-2-[(4-oxochromen-3-yl)methylidene]hydrazinyl]hexyl]carbamate.
Chemical Property Profile of PubChem SID: 26667032
Property Insights of PubChem SID: 26667032
The XLogP value of 3.3282 indicates that PubChem SID: 26667032 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for PubChem SID: 26667032. Following Lipinski's Rule of Five, PubChem SID: 26667032 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 PubChem SID: 26667032?
The CAS number of PubChem SID: 26667032 is 587006-27-7.
What is the molecular formula of PubChem SID: 26667032?
The molecular formula of PubChem SID: 26667032 is C21H27N3O5.
What is the molecular weight of PubChem SID: 26667032?
The molecular weight of PubChem SID: 26667032 is 401.20 g/mol.
Where can I buy PubChem SID: 26667032?
You can request a quote for PubChem SID: 26667032 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PubChem SID: 26667032?
Yes, KEHONG BIO provides custom synthesis services for PubChem SID: 26667032 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.