BAS 04443655
TL;DR: BAS 04443655 (CAS 1005059-97-1) is a chemical compound with molecular formula C21H28N2O3 and molecular weight 356.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-bicyclo[2.2.1]hept-5-enylmethyl)piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone
Also Known As: BAS 04443655, [4-(5-bicyclo[2.2.1]hept-2-enylmethyl)piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone, [4-(bicyclo[2.2.1]hept-5-en-2-ylmethyl)piperazin-1-yl](2,3-dimethoxyphenyl)methanone, [4-(BICYCLO[2.2.1]HEPT-5-EN-2-YLMETHYL)PIPERAZINO](2,3-DIMETHOXYPHENYL)METHANONE, 1-{bicyclo[2.2.1]hept-5-en-2-ylmethyl}-4-(2,3-dimethoxybenzoyl)piperazine
| Molecular Formula | C21H28N2O3 |
|---|---|
| Molecular Weight | 356.21 g/mol |
| LogP | 2.6738 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.21 |
| Heavy Atoms | 26 |
| Complexity | 694.49664 |
Chemical Identifiers
| CAS Number | 1005059-97-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)CC3CC4CC3C=C4 |
Product Overview
BAS 04443655 (CAS 1005059-97-1), with molecular formula C21H28N2O3 and molecular weight 356.21 g/mol. IUPAC: [4-(2-bicyclo[2.2.1]hept-5-enylmethyl)piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone.
Chemical Property Profile of BAS 04443655
Property Insights of BAS 04443655
The XLogP value of 2.6738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04443655. With a topological polar surface area (TPSA) of 42.01 Ų, BAS 04443655 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04443655 has 0 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 04443655?
The CAS number of BAS 04443655 is 1005059-97-1.
What is the molecular formula of BAS 04443655?
The molecular formula of BAS 04443655 is C21H28N2O3.
What is the molecular weight of BAS 04443655?
The molecular weight of BAS 04443655 is 356.21 g/mol.
Where can I buy BAS 04443655?
You can request a quote for BAS 04443655 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04443655?
Yes, KEHONG BIO provides custom synthesis services for BAS 04443655 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.