Methyl 10H-phenothiazine-1-carboxylate
TL;DR: Methyl 10H-phenothiazine-1-carboxylate (CAS 5345-31-3) is a chemical compound with molecular formula C14H11NO2S and molecular weight 257.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 10H-phenothiazine-1-carboxylate
Also Known As: Methyl 10H-phenothiazine-1-carboxylate, methyl 1-phenothiazinecarboxylate, Methyl 10H-phenothiazine-1-carboxylate #, 10H-phenothiazine-1-carboxylic acid methyl ester, PHENOTHIAZINE-1-CARBOXYLIC ACID, METHYL ESTER
| Molecular Formula | C14H11NO2S |
|---|---|
| Molecular Weight | 257.05 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.05106 |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 5345-31-3 |
|---|---|
| SMILES | COC(=O)C1=C2C(=CC=C1)SC3=CC=CC=C3N2 |
| InChIKey | GZHAPWRJGXSDSL-UHFFFAOYSA-N |
Product Overview
Methyl 10H-phenothiazine-1-carboxylate (CAS 5345-31-3), with molecular formula C14H11NO2S and molecular weight 257.05 g/mol. IUPAC: methyl 10H-phenothiazine-1-carboxylate.
Chemical Property Profile of Methyl 10H-phenothiazine-1-carboxylate
Property Insights of Methyl 10H-phenothiazine-1-carboxylate
The XLogP value of 3.5 indicates that Methyl 10H-phenothiazine-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 10H-phenothiazine-1-carboxylate. Following Lipinski's Rule of Five, Methyl 10H-phenothiazine-1-carboxylate has 1 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 Methyl 10H-phenothiazine-1-carboxylate?
The CAS number of Methyl 10H-phenothiazine-1-carboxylate is 5345-31-3.
What is the molecular formula of Methyl 10H-phenothiazine-1-carboxylate?
The molecular formula of Methyl 10H-phenothiazine-1-carboxylate is C14H11NO2S.
What is the molecular weight of Methyl 10H-phenothiazine-1-carboxylate?
The molecular weight of Methyl 10H-phenothiazine-1-carboxylate is 257.05 g/mol.
Where can I buy Methyl 10H-phenothiazine-1-carboxylate?
You can request a quote for Methyl 10H-phenothiazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 10H-phenothiazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 10H-phenothiazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.