BAS 02970434
TL;DR: BAS 02970434 (CAS 333749-12-5) is a chemical compound with molecular formula C22H29N3O3S and molecular weight 415.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(3,4-dimethylphenyl)methanesulfonamide
Also Known As: BAS 02970434, N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(3,4-dimethylphenyl)methanesulfonamide
| Molecular Formula | C22H29N3O3S |
|---|---|
| Molecular Weight | 415.19 g/mol |
| LogP | 2.41384 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.19296 |
| Heavy Atoms | 29 |
| Complexity | 952.5227 |
Chemical Identifiers
| CAS Number | 333749-12-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N(CC(=O)N2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)C)C |
Product Overview
BAS 02970434 (CAS 333749-12-5), with molecular formula C22H29N3O3S and molecular weight 415.19 g/mol. IUPAC: N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(3,4-dimethylphenyl)methanesulfonamide.
Chemical Property Profile of BAS 02970434
Property Insights of BAS 02970434
The XLogP value of 2.41384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02970434. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02970434. Following Lipinski's Rule of Five, BAS 02970434 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 02970434?
The CAS number of BAS 02970434 is 333749-12-5.
What is the molecular formula of BAS 02970434?
The molecular formula of BAS 02970434 is C22H29N3O3S.
What is the molecular weight of BAS 02970434?
The molecular weight of BAS 02970434 is 415.19 g/mol.
Where can I buy BAS 02970434?
You can request a quote for BAS 02970434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02970434?
Yes, KEHONG BIO provides custom synthesis services for BAS 02970434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.