Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate
TL;DR: Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate (CAS 333746-36-4) is a chemical compound with molecular formula C23H20N2O5S and molecular weight 436.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate
Also Known As: BAS 02927400, AF-399/40741351, methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate, methyl 4,5-dimethoxy-2-[(10H-phenothiazin-10-ylcarbonyl)amino]benzoate, methyl 4,5-dimethoxy-2-(10H-phenothiazine-10-carboxamido)benzoate
| Molecular Formula | C23H20N2O5S |
|---|---|
| Molecular Weight | 436.11 g/mol |
| LogP | 5.3252 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.10928 |
| Heavy Atoms | 31 |
| Complexity | 1118.9539 |
Chemical Identifiers
| CAS Number | 333746-36-4 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)OC |
Product Overview
Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate (CAS 333746-36-4), with molecular formula C23H20N2O5S and molecular weight 436.11 g/mol. IUPAC: methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate.
Chemical Property Profile of Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate
Property Insights of Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate
The XLogP value of 5.3252 indicates that Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate. Following Lipinski's Rule of Five, Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate?
The CAS number of Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate is 333746-36-4.
What is the molecular formula of Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate?
The molecular formula of Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate is C23H20N2O5S.
What is the molecular weight of Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate?
The molecular weight of Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate is 436.11 g/mol.
Where can I buy Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate?
You can request a quote for Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4,5-dimethoxy-2-(phenothiazine-10-carbonylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.