BAS 00480853
TL;DR: BAS 00480853 (CAS 333395-22-5) is a chemical compound with molecular formula C22H32N6O6 and molecular weight 476.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[4-[(4-ethoxycarbonylpiperazine-1-carbonyl)amino]phenyl]carbamoyl]piperazine-1-carboxylate
Also Known As: BAS 00480853, ethyl 4-[[4-[(4-ethoxycarbonylpiperazine-1-carbonyl)amino]phenyl]carbamoyl]piperazine-1-carboxylate, diethyl 4,4'-((1,4-phenylenebis(azanediyl))bis(carbonyl))bis(piperazine-1-carboxylate), 4-[[4-[(4-carbethoxypiperazine-1-carbonyl)amino]phenyl]carbamoyl]piperazine-1-carboxylic acid ethyl ester, 4-[[4-[[(4-ethoxycarbonyl-1-piperazinyl)-oxomethyl]amino]anilino]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester
| Molecular Formula | C22H32N6O6 |
|---|---|
| Molecular Weight | 476.24 g/mol |
| LogP | 2.2986 |
| Topological Polar Surface Area | 123.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 476.23834 |
| Heavy Atoms | 34 |
| Complexity | 792.1409 |
Chemical Identifiers
| CAS Number | 333395-22-5 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)NC2=CC=C(C=C2)NC(=O)N3CCN(CC3)C(=O)OCC |
Product Overview
BAS 00480853 (CAS 333395-22-5), with molecular formula C22H32N6O6 and molecular weight 476.24 g/mol. IUPAC: ethyl 4-[[4-[(4-ethoxycarbonylpiperazine-1-carbonyl)amino]phenyl]carbamoyl]piperazine-1-carboxylate.
Chemical Property Profile of BAS 00480853
Property Insights of BAS 00480853
The XLogP value of 2.2986 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00480853. The TPSA of 123.76 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00480853. Following Lipinski's Rule of Five, BAS 00480853 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 BAS 00480853?
The CAS number of BAS 00480853 is 333395-22-5.
What is the molecular formula of BAS 00480853?
The molecular formula of BAS 00480853 is C22H32N6O6.
What is the molecular weight of BAS 00480853?
The molecular weight of BAS 00480853 is 476.24 g/mol.
Where can I buy BAS 00480853?
You can request a quote for BAS 00480853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00480853?
Yes, KEHONG BIO provides custom synthesis services for BAS 00480853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.