RefChem:333249
TL;DR: RefChem:333249 (CAS 29465-21-2) is a chemical compound with molecular formula C21H30Cl2F3N3 and molecular weight 451.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[3-(4-methylpiperazin-1-yl)propyl]-5-(trifluoromethyl)-1,2,3,4-tetrahydrocarbazole;dihydrochloride
Also Known As: Carbazole, 1,2,3,4-tetrahydro-9-(3-(4-methyl-1-piperazinyl)propyl)-5(or 7)-(trifluoromethyl)-,dihydrochloride, 9-[3-(4-methylpiperazin-1-yl)propyl]-5-(trifluoromethyl)-1,2,3,4-tetrahydrocarbazole dihydrochloride, CARBAZOLE, 1,2,3,4-TETRAHYDRO-9-(3-(4-METHYL-1-PIPERAZINYL)PROPYL)-5(or 7)-(TRIF, 9-[3-(4-Methylpiperazin-1-yl)propyl]-5-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole--hydrogen chloride (1/2), RefChem:333249
| Molecular Formula | C21H30Cl2F3N3 |
|---|---|
| Molecular Weight | 451.18 g/mol |
| LogP | 5.02 |
| Topological Polar Surface Area | 11.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.17688 |
| Heavy Atoms | 29 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 29465-21-2 |
|---|---|
| SMILES | CN1CCN(CC1)CCCN2C3=C(CCCC3)C4=C(C=CC=C42)C(F)(F)F.Cl.Cl |
| InChIKey | FXARNZGSCHEKQZ-UHFFFAOYSA-N |
Product Overview
RefChem:333249 (CAS 29465-21-2), with molecular formula C21H30Cl2F3N3 and molecular weight 451.18 g/mol. IUPAC: 9-[3-(4-methylpiperazin-1-yl)propyl]-5-(trifluoromethyl)-1,2,3,4-tetrahydrocarbazole;dihydrochloride.
Chemical Property Profile of RefChem:333249
Property Insights of RefChem:333249
The XLogP value of 5.02 indicates that RefChem:333249 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 11.4 Ų, RefChem:333249 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:333249 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:333249?
The CAS number of RefChem:333249 is 29465-21-2.
What is the molecular formula of RefChem:333249?
The molecular formula of RefChem:333249 is C21H30Cl2F3N3.
What is the molecular weight of RefChem:333249?
The molecular weight of RefChem:333249 is 451.18 g/mol.
Where can I buy RefChem:333249?
You can request a quote for RefChem:333249 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:333249?
Yes, KEHONG BIO provides custom synthesis services for RefChem:333249 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.