RefChem:1069988
TL;DR: RefChem:1069988 (CAS 37708-01-3) is a chemical compound with molecular formula C19H30Cl2N2O and molecular weight 372.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-tert-butyl-3-chlorophenyl)-1-(4-methylpiperazin-1-yl)butan-1-one;hydrochloride
Also Known As: 1-(4-(3-Chloro-4-(1,1-dimethylethyl)phenyl)-1-oxobutyl)-4-methylpiperazine hydrochloride, 3-(3-Chloro-4-isopropylphenyl)-1-morpholinocarbonyl-propan, 4-(4-tert-butyl-3-chlorophenyl)-1-(4-methylpiperazin-1-yl)butan-1-one hydrochloride(1:1), 4-(4-tert-Butyl-3-chlorophenyl)-1-(4-methylpiperazin-1-yl)butan-1-one--hydrogen chloride (1/1), Piperazine, 1-(4-(3-chloro-4-(1,1-dimethylethyl)phenyl)-1-oxobutyl)-4-methyl-, monohydrochloride
| Molecular Formula | C19H30Cl2N2O |
|---|---|
| Molecular Weight | 372.17 g/mol |
| LogP | 4.156 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.17352 |
| Heavy Atoms | 24 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 37708-01-3 |
|---|---|
| SMILES | CC(C)(C)C1=C(C=C(C=C1)CCCC(=O)N2CCN(CC2)C)Cl.Cl |
| InChIKey | QSPLWKBVCSYWTM-UHFFFAOYSA-N |
Product Overview
RefChem:1069988 (CAS 37708-01-3), with molecular formula C19H30Cl2N2O and molecular weight 372.17 g/mol. IUPAC: 4-(4-tert-butyl-3-chlorophenyl)-1-(4-methylpiperazin-1-yl)butan-1-one;hydrochloride.
Chemical Property Profile of RefChem:1069988
Property Insights of RefChem:1069988
The XLogP value of 4.156 indicates that RefChem:1069988 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, RefChem:1069988 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1069988 has 1 hydrogen bond donor(s) and 2 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 RefChem:1069988?
The CAS number of RefChem:1069988 is 37708-01-3.
What is the molecular formula of RefChem:1069988?
The molecular formula of RefChem:1069988 is C19H30Cl2N2O.
What is the molecular weight of RefChem:1069988?
The molecular weight of RefChem:1069988 is 372.17 g/mol.
Where can I buy RefChem:1069988?
You can request a quote for RefChem:1069988 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1069988?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1069988 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.