![[1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea structure](/static/products/6694/66949-59-5.webp)
[1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea
TL;DR: [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea (CAS 66949-59-5) is a chemical compound with molecular formula C17H15Cl2N3OS and molecular weight 379.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea
Also Known As: [(Z)-1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethyli
| Molecular Formula | C17H15Cl2N3OS |
|---|---|
| Molecular Weight | 379.03 g/mol |
| LogP | 4.5676 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.03128 |
| Heavy Atoms | 24 |
| Complexity | 838.5805 |
Chemical Identifiers
| CAS Number | 66949-59-5 |
|---|---|
| SMILES | CC(=NNC(=O)N)C1=CC2=C(C=C1)SC3=C(C2CCl)C=C(C=C3)Cl |
Product Overview
[1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea (CAS 66949-59-5), with molecular formula C17H15Cl2N3OS and molecular weight 379.03 g/mol. IUPAC: [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea.
Chemical Property Profile of [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea
Property Insights of [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea
The XLogP value of 4.5676 indicates that [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.48 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea. Following Lipinski's Rule of Five, [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea has 2 hydrogen bond donor(s) and 3 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-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea?
The CAS number of [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea is 66949-59-5.
What is the molecular formula of [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea?
The molecular formula of [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea is C17H15Cl2N3OS.
What is the molecular weight of [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea?
The molecular weight of [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea is 379.03 g/mol.
Where can I buy [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea?
You can request a quote for [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea?
Yes, KEHONG BIO provides custom synthesis services for [1-[7-chloro-9-(chloromethyl)-9H-thioxanthen-2-yl]ethylideneamino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.