CI 953
TL;DR: CI 953 (CAS 124421-10-9) is a chemical compound with molecular formula C13H13Cl2N3O and molecular weight 297.04358 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-chloro-6-methylphenyl)-3-pyridin-4-ylurea;hydrochloride
Also Known As: CI 953, Color Index No. 953, Color Index Number 953, Colour Index No. 953, Colour Index Number 953
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H13Cl2N3O |
| Molecular Weight | 297.04358 g/mol |
| XLogP | 4.10922 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.04358 Da |
| Heavy Atoms | 19 |
| Complexity | 281.0 |
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)NC2=CC=NC=C2.Cl |
| InChIKey | AQIVEWAADQUAHH-UHFFFAOYSA-N |
Chemical Property Profile of CI 953
Property Insights of CI 953
The XLogP value of 4.10922 indicates that CI 953 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, CI 953 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CI 953 has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of CI 953?
The CAS number of CI 953 is 124421-10-9.
What is the molecular formula of CI 953?
The molecular formula of CI 953 is C13H13Cl2N3O.
What is the molecular weight of CI 953?
The molecular weight of CI 953 is 297.04358 g/mol.
Where can I buy CI 953?
You can request a quote for CI 953 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for CI 953?
Yes, CoreyChem provides custom synthesis services for CI 953 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.