Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate
TL;DR: Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate (CAS 328027-01-6) is a chemical compound with molecular formula C16H21N3O5 and molecular weight 335.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-[4-(butanoylamino)benzoyl]hydrazinyl]-4-oxobutanoate
Also Known As: BAS 02983835, methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate, AN-329/40614799, methyl 4-[2-[4-(butanoylamino)benzoyl]hydrazinyl]-4-oxobutanoate, METHYL 4-[(4-BUTANAMIDOPHENYL)FORMOHYDRAZIDO]-4-OXOBUTANOATE
| Molecular Formula | C16H21N3O5 |
|---|---|
| Molecular Weight | 335.15 g/mol |
| LogP | 1.1394 |
| Topological Polar Surface Area | 113.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 335.14813 |
| Heavy Atoms | 24 |
| Complexity | 598.23535 |
Chemical Identifiers
| CAS Number | 328027-01-6 |
|---|---|
| SMILES | CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)CCC(=O)OC |
Product Overview
Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate (CAS 328027-01-6), with molecular formula C16H21N3O5 and molecular weight 335.15 g/mol. IUPAC: methyl 4-[2-[4-(butanoylamino)benzoyl]hydrazinyl]-4-oxobutanoate.
Chemical Property Profile of Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate
Property Insights of Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate
The XLogP value of 1.1394 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate. The TPSA of 113.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate. Following Lipinski's Rule of Five, Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate has 3 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 Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate?
The CAS number of Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate is 328027-01-6.
What is the molecular formula of Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate?
The molecular formula of Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate is C16H21N3O5.
What is the molecular weight of Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate?
The molecular weight of Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate is 335.15 g/mol.
Where can I buy Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate?
You can request a quote for Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{2-[4-(butyrylamino)benzoyl]hydrazino}-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.