![ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate structure](/static/products/118/1185447-94-2.png)
ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate
TL;DR: ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate (CAS 1185447-94-2) is a chemical compound with molecular formula C25H29N3O7 and molecular weight 483.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl]piperazine-1-carboxylate;oxalic acid
Also Known As: ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate, ethyl 4-[2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl]-1-piperazinecarboxylate oxalate, ethyl 4-[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl]piperazine-1-carboxylate; oxalic acid
| Molecular Formula | C25H29N3O7 |
|---|---|
| Molecular Weight | 483.20 g/mol |
| LogP | 2.3796 |
| Topological Polar Surface Area | 127.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 483.20056 |
| Heavy Atoms | 35 |
| Complexity | 1020.73505 |
Chemical Identifiers
| CAS Number | 1185447-94-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CC(=O)N2C3=CC=CC=C3CCC4=CC=CC=C42.C(=O)(C(=O)O)O |
Product Overview
ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate (CAS 1185447-94-2), with molecular formula C25H29N3O7 and molecular weight 483.20 g/mol. IUPAC: ethyl 4-[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl]piperazine-1-carboxylate;oxalic acid.
Chemical Property Profile of ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate
Property Insights of ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate
The XLogP value of 2.3796 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate. The TPSA of 127.69 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate. Following Lipinski's Rule of Five, ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate 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 ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate?
The CAS number of ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate is 1185447-94-2.
What is the molecular formula of ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate?
The molecular formula of ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate is C25H29N3O7.
What is the molecular weight of ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate?
The molecular weight of ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate is 483.20 g/mol.
Where can I buy ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate?
You can request a quote for ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(2-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-oxoethyl)piperazine-1-carboxylate oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.