BAS 01530426
TL;DR: BAS 01530426 (CAS 339293-19-5) is a chemical compound with molecular formula C16H22BrN3O3 and molecular weight 383.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(3-bromoanilino)-3-oxopropyl]piperazine-1-carboxylate
Also Known As: BAS 01530426, A1099/0051622, Ethyl 4-[3-(3-bromoanilino)-3-oxopropyl]-1-piperazinecarboxylate, Ethyl 4-[3-(3-bromoanilino)-3-oxopropyl]-1-piperazinecarboxylate #, ethyl 4-[3-(3-bromoanilino)-3-oxopropyl]piperazine-1-carboxylate
| Molecular Formula | C16H22BrN3O3 |
|---|---|
| Molecular Weight | 383.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 61.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.08444 |
| Heavy Atoms | 23 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 339293-19-5 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CCC(=O)NC2=CC(=CC=C2)Br |
| InChIKey | LSZFDOVWASJLSQ-UHFFFAOYSA-N |
Product Overview
BAS 01530426 (CAS 339293-19-5), with molecular formula C16H22BrN3O3 and molecular weight 383.08 g/mol. IUPAC: ethyl 4-[3-(3-bromoanilino)-3-oxopropyl]piperazine-1-carboxylate.
Chemical Property Profile of BAS 01530426
Property Insights of BAS 01530426
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01530426. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01530426. Following Lipinski's Rule of Five, BAS 01530426 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 BAS 01530426?
The CAS number of BAS 01530426 is 339293-19-5.
What is the molecular formula of BAS 01530426?
The molecular formula of BAS 01530426 is C16H22BrN3O3.
What is the molecular weight of BAS 01530426?
The molecular weight of BAS 01530426 is 383.08 g/mol.
Where can I buy BAS 01530426?
You can request a quote for BAS 01530426 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01530426?
Yes, KEHONG BIO provides custom synthesis services for BAS 01530426 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.