BAS 01840311
TL;DR: BAS 01840311 (CAS 355819-47-5) is a chemical compound with molecular formula C22H29N3O6 and molecular weight 431.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]piperazine
Also Known As: BAS 01840311, 1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]piperazine, AB00099801-01, 1-(3,4-Dimethoxy-benzyl)-4-(4,5-dimethoxy-2-nitro-benzyl)-piperazine, 1-(3,4-dimethoxybenzyl)-4-(4,5-dimethoxy-2-nitrobenzyl)piperazine
| Molecular Formula | C22H29N3O6 |
|---|---|
| Molecular Weight | 431.21 g/mol |
| LogP | 2.947 |
| Topological Polar Surface Area | 86.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 431.20563 |
| Heavy Atoms | 31 |
| Complexity | 912.3595 |
Chemical Identifiers
| CAS Number | 355819-47-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN2CCN(CC2)CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)OC |
Product Overview
BAS 01840311 (CAS 355819-47-5), with molecular formula C22H29N3O6 and molecular weight 431.21 g/mol. IUPAC: 1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]piperazine.
Chemical Property Profile of BAS 01840311
Property Insights of BAS 01840311
The XLogP value of 2.947 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01840311. The TPSA of 86.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01840311. Following Lipinski's Rule of Five, BAS 01840311 has 0 hydrogen bond donor(s) and 8 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 01840311?
The CAS number of BAS 01840311 is 355819-47-5.
What is the molecular formula of BAS 01840311?
The molecular formula of BAS 01840311 is C22H29N3O6.
What is the molecular weight of BAS 01840311?
The molecular weight of BAS 01840311 is 431.21 g/mol.
Where can I buy BAS 01840311?
You can request a quote for BAS 01840311 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01840311?
Yes, KEHONG BIO provides custom synthesis services for BAS 01840311 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.