RefChem:369497
TL;DR: RefChem:369497 (CAS 5798-15-2) is a chemical compound with molecular formula C23H28Cl2F3N3S and molecular weight 505.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-[3-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)propyl]-2-(trifluoromethyl)phenothiazine;dihydrochloride
Also Known As: Phenothiazine, 10-(3-(3-methyl-3,8-diazabicyclo(3.2.1)oct-8-yl)propyl)-2-trifluoromethyl-, dihydrochloride, 10-[3-(3-Methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)propyl]-2-(trifluoromethyl)-10H-phenothiazine--hydrogen chloride (1/2), 10-[3-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)propyl]-2-(trifluoromethyl)phenothiazine dihydrochloride, Phenothiazine, 10-[3-(3-methyl-3,8-diazabicyclo[3.2.1]oct-8-yl)propyl]-2-(trifluoromethyl)-, dihydrochloride, RefChem:369497
| Molecular Formula | C23H28Cl2F3N3S |
|---|---|
| Molecular Weight | 505.13 g/mol |
| LogP | 6.3202 |
| Topological Polar Surface Area | 35.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 505.1333 |
| Heavy Atoms | 32 |
| Complexity | 589.0 |
Chemical Identifiers
| CAS Number | 5798-15-2 |
|---|---|
| SMILES | CN1CC2CCC(C1)N2CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)C(F)(F)F.Cl.Cl |
| InChIKey | LVSMPEFVRHJDPO-UHFFFAOYSA-N |
Product Overview
RefChem:369497 (CAS 5798-15-2), with molecular formula C23H28Cl2F3N3S and molecular weight 505.13 g/mol. IUPAC: 10-[3-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)propyl]-2-(trifluoromethyl)phenothiazine;dihydrochloride.
Chemical Property Profile of RefChem:369497
Property Insights of RefChem:369497
The XLogP value of 6.3202 indicates that RefChem:369497 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.0 Ų, RefChem:369497 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:369497 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:369497?
The CAS number of RefChem:369497 is 5798-15-2.
What is the molecular formula of RefChem:369497?
The molecular formula of RefChem:369497 is C23H28Cl2F3N3S.
What is the molecular weight of RefChem:369497?
The molecular weight of RefChem:369497 is 505.13 g/mol.
Where can I buy RefChem:369497?
You can request a quote for RefChem:369497 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:369497?
Yes, KEHONG BIO provides custom synthesis services for RefChem:369497 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.