![2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone structure](/static/products/4197/41979-47-9.webp)
2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone
TL;DR: 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone (CAS 41979-47-9) is a chemical compound with molecular formula C22H14ClNOS and molecular weight 375.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(2-thia-13-azapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaen-13-yl)ethanone
Also Known As: NCIOpen2_009015, 2-chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone, 14-chloroacetyl-14H-dibenzo[a,h]phenothiazine, 2-Chloro-1-(14H-dibenzo[a,h]phenothiazin-14-yl)ethan-1-one
| Molecular Formula | C22H14ClNOS |
|---|---|
| Molecular Weight | 375.05 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 375.04846 |
| Heavy Atoms | 26 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 41979-47-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2N(C4=C(S3)C5=CC=CC=C5C=C4)C(=O)CCl |
| InChIKey | HBHPGJFKSZCDRJ-UHFFFAOYSA-N |
Product Overview
2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone (CAS 41979-47-9), with molecular formula C22H14ClNOS and molecular weight 375.05 g/mol. IUPAC: 2-chloro-1-(2-thia-13-azapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaen-13-yl)ethanone.
Chemical Property Profile of 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone
Property Insights of 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone
The XLogP value of 6.1 indicates that 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.6 Ų, 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone?
The CAS number of 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone is 41979-47-9.
What is the molecular formula of 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone?
The molecular formula of 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone is C22H14ClNOS.
What is the molecular weight of 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone?
The molecular weight of 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone is 375.05 g/mol.
Where can I buy 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone?
You can request a quote for 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1-(14h-dibenzo[a,h]phenothiazin-14-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.