10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine
TL;DR: 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine (CAS 128175-14-4) is a chemical compound with molecular formula C21H13ClN2O2S2 and molecular weight 424.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylsulfanyl)-1-(2-chlorophenothiazin-10-yl)ethanone
Also Known As: 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine, 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(2-chlorophenothiazin-10-yl)ethanone, AN-919/40736576, 1,3-benzoxazol-2-yl 2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl sulfide, 2-benzoxazol-2-ylthio-1-(2-chlorophenothiazin-10-yl)ethan-1-one
| Molecular Formula | C21H13ClN2O2S2 |
|---|---|
| Molecular Weight | 424.01 g/mol |
| LogP | 6.4028 |
| Topological Polar Surface Area | 46.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 424.0107 |
| Heavy Atoms | 28 |
| Complexity | 1174.9675 |
Chemical Identifiers
| CAS Number | 128175-14-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)SCC(=O)N3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl |
Product Overview
10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine (CAS 128175-14-4), with molecular formula C21H13ClN2O2S2 and molecular weight 424.01 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(2-chlorophenothiazin-10-yl)ethanone.
Chemical Property Profile of 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine
Property Insights of 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine
The XLogP value of 6.4028 indicates that 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.34 Ų, 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine has 0 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 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine?
The CAS number of 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine is 128175-14-4.
What is the molecular formula of 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine?
The molecular formula of 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine is C21H13ClN2O2S2.
What is the molecular weight of 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine?
The molecular weight of 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine is 424.01 g/mol.
Where can I buy 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine?
You can request a quote for 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine?
Yes, KEHONG BIO provides custom synthesis services for 10-[(1,3-benzoxazol-2-ylthio)acetyl]-2-chloro-10H-phenothiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.