![1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one structure](/static/products/5875/58754-72-6.webp)
1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one
TL;DR: 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one (CAS 58754-72-6) is a chemical compound with molecular formula C22H16ClNO3S and molecular weight 409.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2-chloroacetyl)phenothiazin-10-yl]-2-phenoxyethanone
Also Known As: 1-[2-(2-chloroacetyl)phenothiazin-10-yl]-2-phenoxyethanone, 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one
| Molecular Formula | C22H16ClNO3S |
|---|---|
| Molecular Weight | 409.05 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 71.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.05396 |
| Heavy Atoms | 28 |
| Complexity | 568.0 |
Chemical Identifiers
| CAS Number | 58754-72-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=O)CCl |
| InChIKey | OYKWZOKAPQWJLN-UHFFFAOYSA-N |
Product Overview
1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one (CAS 58754-72-6), with molecular formula C22H16ClNO3S and molecular weight 409.05 g/mol. IUPAC: 1-[2-(2-chloroacetyl)phenothiazin-10-yl]-2-phenoxyethanone.
Chemical Property Profile of 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one
Property Insights of 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one
The XLogP value of 5.0 indicates that 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one. Following Lipinski's Rule of Five, 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one 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 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one?
The CAS number of 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one is 58754-72-6.
What is the molecular formula of 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one?
The molecular formula of 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one is C22H16ClNO3S.
What is the molecular weight of 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one?
The molecular weight of 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one is 409.05 g/mol.
Where can I buy 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one?
You can request a quote for 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(Chloroacetyl)-10H-phenothiazin-10-yl]-2-phenoxyethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.