RefChem:369507
TL;DR: RefChem:369507 (CAS 38259-63-1) is a chemical compound with molecular formula C27H33N3O8S and molecular weight 559.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-[3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)propyl]phenothiazine;oxalic acid
Also Known As: 10-(3-(Octahydro-2H-pyrido(1,2-a)pyrazin-2-yl)propyl)phenothiazine maleate, Phenothiazine, 10-(3-(octahydro-2H-pyrido(1,2-a)pyrazin-2-yl)propyl)-, maleate (1:2), 10-[3-(octahydro-2h-pyrido[1,2-a]pyrazin-2-yl)propyl]-10h-phenothiazine ethanedioate(1:2), 10-[3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)propyl]phenothiazine; oxalic acid, Oxalic acid--10-[3-(octahydro-2H-pyrido[1,2-a]pyrazin-2-yl)propyl]-10H-phenothiazine (2/1)
| Molecular Formula | C27H33N3O8S |
|---|---|
| Molecular Weight | 559.20 g/mol |
| LogP | 3.1607 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 559.19885 |
| Heavy Atoms | 39 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 38259-63-1 |
|---|---|
| SMILES | C1CCN2CCN(CC2C1)CCCN3C4=CC=CC=C4SC5=CC=CC=C53.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O |
| InChIKey | PKHMUPRBGWAHCC-UHFFFAOYSA-N |
Product Overview
RefChem:369507 (CAS 38259-63-1), with molecular formula C27H33N3O8S and molecular weight 559.20 g/mol. IUPAC: 10-[3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)propyl]phenothiazine;oxalic acid.
Chemical Property Profile of RefChem:369507
Property Insights of RefChem:369507
The XLogP value of 3.1607 indicates that RefChem:369507 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.0 Ų indicates high polarity, suggesting RefChem:369507 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:369507 has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:369507?
The CAS number of RefChem:369507 is 38259-63-1.
What is the molecular formula of RefChem:369507?
The molecular formula of RefChem:369507 is C27H33N3O8S.
What is the molecular weight of RefChem:369507?
The molecular weight of RefChem:369507 is 559.20 g/mol.
Where can I buy RefChem:369507?
You can request a quote for RefChem:369507 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:369507?
Yes, KEHONG BIO provides custom synthesis services for RefChem:369507 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.