RefChem:1062728
TL;DR: RefChem:1062728 (CAS 10404-90-7) is a chemical compound with molecular formula C17H19ClN2O2S and molecular weight 350.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-10-oxido-5-oxophenothiazin-10-ium-10-yl)-N,N-dimethylpropan-1-amine
Also Known As: Chlorpromazine-N-S-dioxide, Chloropromazine N-oxide sulfoxide, ChlorpromazineN-OxideSulfoxide, 2-Chloro-10-(3-(dimethylamino)propyl)phenothiazine N,5-dioxide, Chlorpromazine Sulfoxide N-oxide Impurity
| Molecular Formula | C17H19ClN2O2S |
|---|---|
| Molecular Weight | 350.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.08557 |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 10404-90-7 |
|---|---|
| SMILES | CN(C)CCC[N+]1(C2=CC=CC=C2S(=O)C3=C1C=C(C=C3)Cl)[O-] |
| InChIKey | FNEGGPSDGPPUHP-UHFFFAOYSA-N |
Product Overview
RefChem:1062728 (CAS 10404-90-7), with molecular formula C17H19ClN2O2S and molecular weight 350.09 g/mol. IUPAC: 3-(2-chloro-10-oxido-5-oxophenothiazin-10-ium-10-yl)-N,N-dimethylpropan-1-amine.
Chemical Property Profile of RefChem:1062728
Property Insights of RefChem:1062728
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1062728. With a topological polar surface area (TPSA) of 57.6 Ų, RefChem:1062728 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1062728 has 0 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 RefChem:1062728?
The CAS number of RefChem:1062728 is 10404-90-7.
What is the molecular formula of RefChem:1062728?
The molecular formula of RefChem:1062728 is C17H19ClN2O2S.
What is the molecular weight of RefChem:1062728?
The molecular weight of RefChem:1062728 is 350.09 g/mol.
Where can I buy RefChem:1062728?
You can request a quote for RefChem:1062728 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1062728?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1062728 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.