4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate
TL;DR: 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate (CAS 19365-76-5) is a chemical compound with molecular formula C18H15NO4 and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzamido-7-oxocyclohepta-1,3,5-trien-1-yl) 2-methylprop-2-enoate
Also Known As: 4-(benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate, (4-benzamido-7-oxocyclohepta-1,3,5-trien-1-yl) 2-methylprop-, (4-benzamido-7-oxocyclohepta-1,3,5-trien-1-yl) 2-methylprop-2-enoate, 2-Propenoicacid, 2-methyl-, 4-(benzoylamino)-7-oxo-1,3,5-cycloheptatrien-1-yl ester, 4-BENZAMIDO-7-OXOCYCLOHEPTA-1,3,5-TRIEN-1-YL 2-METHYLPROP-2-ENOATE
| Molecular Formula | C18H15NO4 |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.1001 |
| Heavy Atoms | 23 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 19365-76-5 |
|---|---|
| SMILES | CC(=C)C(=O)OC1=CC=C(C=CC1=O)NC(=O)C2=CC=CC=C2 |
| InChIKey | BCOHGZMLUIZXRH-UHFFFAOYSA-N |
Product Overview
4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate (CAS 19365-76-5), with molecular formula C18H15NO4 and molecular weight 309.10 g/mol. IUPAC: (4-benzamido-7-oxocyclohepta-1,3,5-trien-1-yl) 2-methylprop-2-enoate.
Chemical Property Profile of 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate
Property Insights of 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate
The XLogP value of 3.1 indicates that 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate. Following Lipinski's Rule of Five, 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate has 1 hydrogen bond donor(s) and 4 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 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate?
The CAS number of 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate is 19365-76-5.
What is the molecular formula of 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate?
The molecular formula of 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate is C18H15NO4.
What is the molecular weight of 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate?
The molecular weight of 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate is 309.10 g/mol.
Where can I buy 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate?
You can request a quote for 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzoylamino)-7-oxocyclohepta-1,3,5-trien-1-yl 2-methylprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.