(6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid
TL;DR: (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid (CAS 80845-82-5) is a chemical compound with molecular formula C11H21N3O3 and molecular weight 243.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid
Also Known As: D-3-isopropyl-6-semicarbazono-heptanoic acid, 6-(2-carbamoylhydrazinylidene)-3-(propan-2-yl)heptanoic acid
| Molecular Formula | C11H21N3O3 |
|---|---|
| Molecular Weight | 243.16 g/mol |
| LogP | 1.5577 |
| Topological Polar Surface Area | 104.78 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 243.1583 |
| Heavy Atoms | 17 |
| Complexity | 300.3368 |
Chemical Identifiers
| CAS Number | 80845-82-5 |
|---|---|
| SMILES | CC(C)C(CC/C(=N/NC(=O)N)/C)CC(=O)O |
Product Overview
(6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid (CAS 80845-82-5), with molecular formula C11H21N3O3 and molecular weight 243.16 g/mol. IUPAC: (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid.
Chemical Property Profile of (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid
Property Insights of (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid
The XLogP value of 1.5577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid. The TPSA of 104.78 Ų falls within the moderate polarity range, balancing permeability and solubility for (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid. Following Lipinski's Rule of Five, (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid has 3 hydrogen bond donor(s) and 3 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 (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid?
The CAS number of (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid is 80845-82-5.
What is the molecular formula of (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid?
The molecular formula of (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid is C11H21N3O3.
What is the molecular weight of (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid?
The molecular weight of (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid is 243.16 g/mol.
Where can I buy (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid?
You can request a quote for (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (6E)-6-(carbamoylhydrazinylidene)-3-propan-2-ylheptanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.