N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide
TL;DR: N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide (CAS 5733-65-3) is a chemical compound with molecular formula C16H13N3O4 and molecular weight 311.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide
Also Known As: BAS 00853090, N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide, 8-allyl-N'-(cyanoacetyl)-2-oxo-2H-chromene-3-carbohydrazide, 8-Allyl-2-oxo-2H-chromene-3-carboxylic acid N'-(2-cyano-acetyl)-hydrazide, N'-(Cyanoacetyl)-2-oxo-8-(prop-2-en-1-yl)-2H-1-benzopyran-3-carbohydrazide
| Molecular Formula | C16H13N3O4 |
|---|---|
| Molecular Weight | 311.09 g/mol |
| LogP | 1.19618 |
| Topological Polar Surface Area | 112.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.0906 |
| Heavy Atoms | 23 |
| Complexity | 877.0048 |
Chemical Identifiers
| CAS Number | 5733-65-3 |
|---|---|
| SMILES | C=CCC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NNC(=O)CC#N |
Product Overview
N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide (CAS 5733-65-3), with molecular formula C16H13N3O4 and molecular weight 311.09 g/mol. IUPAC: N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide.
Chemical Property Profile of N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide
Property Insights of N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide
The XLogP value of 1.19618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide. The TPSA of 112.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide. Following Lipinski's Rule of Five, N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide has 2 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 N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide?
The CAS number of N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide is 5733-65-3.
What is the molecular formula of N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide?
The molecular formula of N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide is C16H13N3O4.
What is the molecular weight of N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide?
The molecular weight of N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide is 311.09 g/mol.
Where can I buy N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide?
You can request a quote for N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-(2-cyanoacetyl)-2-oxo-8-prop-2-enylchromene-3-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.