Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-
TL;DR: Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- (CAS 71481-78-2) is a chemical compound with molecular formula C18H22N3S+ and molecular weight 312.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[7-(dimethylamino)-1,9-dimethylphenothiazin-3-ylidene]-dimethylazanium
Also Known As: Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-, 1,9-Dimethyl-3,7-di(dimethylamino)phenothiazine-5-ium, 3,7-Bis(dimethylamino)-1,9-dimethylphenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-5lambda4-phenothiazin-5-ylium, (7-dimethylamino-1,9-dimethyl-phenothiazin-3-ylidene)-dimethyl-azanium
| Molecular Formula | C18H22N3S+ |
|---|---|
| Molecular Weight | 312.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 43.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.15344 |
| Heavy Atoms | 22 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 71481-78-2 |
|---|---|
| SMILES | CC1=CC(=CC2=C1N=C3C(=CC(=[N+](C)C)C=C3S2)C)N(C)C |
| InChIKey | VVEWWLHKADXQQL-UHFFFAOYSA-N |
Product Overview
Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- (CAS 71481-78-2), with molecular formula C18H22N3S+ and molecular weight 312.15 g/mol. IUPAC: [7-(dimethylamino)-1,9-dimethylphenothiazin-3-ylidene]-dimethylazanium.
Chemical Property Profile of Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-
Property Insights of Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-
The XLogP value of 3.0 indicates that Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.9 Ų, Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- has 0 hydrogen bond donor(s) and 3 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 Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-?
The CAS number of Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- is 71481-78-2.
What is the molecular formula of Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-?
The molecular formula of Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- is C18H22N3S+.
What is the molecular weight of Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-?
The molecular weight of Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- is 312.15 g/mol.
Where can I buy Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-?
You can request a quote for Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Phenothiazin-5-ium, 3,7-bis(dimethylamino)-1,9-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.