![3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate structure](/static/products/332/332102-70-2.png)
3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate
TL;DR: 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate (CAS 332102-70-2) is a chemical compound with molecular formula C28H17NO4S and molecular weight 463.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methyl-8,13-dioxo-14H-naphtho[2,3-a]phenothiazin-7-yl) benzoate
Also Known As: BAS 01121661, 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate, (3-methyl-8,13-dioxo-14H-naphtho[2,3-a]phenothiazin-7-yl) benzoate
| Molecular Formula | C28H17NO4S |
|---|---|
| Molecular Weight | 463.09 g/mol |
| LogP | 5.93702 |
| Topological Polar Surface Area | 76.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 463.08783 |
| Heavy Atoms | 34 |
| Complexity | 1902.345 |
Chemical Identifiers
| CAS Number | 332102-70-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C(S2)C=C(C4=C3C(=O)C5=CC=CC=C5C4=O)OC(=O)C6=CC=CC=C6 |
Product Overview
3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate (CAS 332102-70-2), with molecular formula C28H17NO4S and molecular weight 463.09 g/mol. IUPAC: (3-methyl-8,13-dioxo-14H-naphtho[2,3-a]phenothiazin-7-yl) benzoate.
Chemical Property Profile of 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate
Property Insights of 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate
The XLogP value of 5.93702 indicates that 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate. Following Lipinski's Rule of Five, 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate?
The CAS number of 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate is 332102-70-2.
What is the molecular formula of 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate?
The molecular formula of 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate is C28H17NO4S.
What is the molecular weight of 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate?
The molecular weight of 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate is 463.09 g/mol.
Where can I buy 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate?
You can request a quote for 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenothiazin-7-yl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.