BAS 01150701
TL;DR: BAS 01150701 (CAS 324774-65-4) is a chemical compound with molecular formula C21H19ClN2O3S and molecular weight 414.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloro-1-benzothiophen-2-yl)methanone
Also Known As: BAS 01150701, BIM-0035338.P001, UPCMLD0ENAT0502-8871:001, 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-chloro-1-benzothiophene-2-carbonyl)piperazine, AB00099321-01
| Molecular Formula | C21H19ClN2O3S |
|---|---|
| Molecular Weight | 414.08 g/mol |
| LogP | 4.2414 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.0805 |
| Heavy Atoms | 28 |
| Complexity | 1043.3068 |
Chemical Identifiers
| CAS Number | 324774-65-4 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=C(C5=CC=CC=C5S4)Cl |
Product Overview
BAS 01150701 (CAS 324774-65-4), with molecular formula C21H19ClN2O3S and molecular weight 414.08 g/mol. IUPAC: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloro-1-benzothiophen-2-yl)methanone.
Chemical Property Profile of BAS 01150701
Property Insights of BAS 01150701
The XLogP value of 4.2414 indicates that BAS 01150701 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.01 Ų, BAS 01150701 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01150701 has 0 hydrogen bond donor(s) and 5 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 01150701?
The CAS number of BAS 01150701 is 324774-65-4.
What is the molecular formula of BAS 01150701?
The molecular formula of BAS 01150701 is C21H19ClN2O3S.
What is the molecular weight of BAS 01150701?
The molecular weight of BAS 01150701 is 414.08 g/mol.
Where can I buy BAS 01150701?
You can request a quote for BAS 01150701 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01150701?
Yes, KEHONG BIO provides custom synthesis services for BAS 01150701 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.