CRL 41242
TL;DR: CRL 41242 (CAS 97111-11-0) is a chemical compound with molecular formula C16H25Cl2N3O2 and molecular weight 361.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[2-(4-methylpiperazin-1-yl)propanoyl]phenyl]acetamide;dihydrochloride
Also Known As: CRL 41242, 1-2- propanonedihydrochloride, 1- -2- propanonedihydrochloride, N-(4-(2-(4-Methyl-1-piperazinyl)-1-oxopropyl)phenyl)acetamide dihydrochloride, 1-(4-Acetylaminophenyl)-2-(4-methylpiperazino)propanone dihydrochloride
| Molecular Formula | C16H25Cl2N3O2 |
|---|---|
| Molecular Weight | 361.13 g/mol |
| LogP | 2.3072 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.1324 |
| Heavy Atoms | 23 |
| Complexity | 514.5616 |
Chemical Identifiers
| CAS Number | 97111-11-0 |
|---|---|
| SMILES | CC(C(=O)C1=CC=C(C=C1)NC(=O)C)N2CCN(CC2)C.Cl.Cl |
Product Overview
CRL 41242 (CAS 97111-11-0), with molecular formula C16H25Cl2N3O2 and molecular weight 361.13 g/mol. IUPAC: N-[4-[2-(4-methylpiperazin-1-yl)propanoyl]phenyl]acetamide;dihydrochloride.
Chemical Property Profile of CRL 41242
Property Insights of CRL 41242
The XLogP value of 2.3072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CRL 41242. With a topological polar surface area (TPSA) of 52.65 Ų, CRL 41242 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CRL 41242 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 CRL 41242?
The CAS number of CRL 41242 is 97111-11-0.
What is the molecular formula of CRL 41242?
The molecular formula of CRL 41242 is C16H25Cl2N3O2.
What is the molecular weight of CRL 41242?
The molecular weight of CRL 41242 is 361.13 g/mol.
Where can I buy CRL 41242?
You can request a quote for CRL 41242 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CRL 41242?
Yes, KEHONG BIO provides custom synthesis services for CRL 41242 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.