NCI60_020876
TL;DR: NCI60_020876 (CAS 101564-41-4) is a chemical compound with molecular formula C10H13Cl2F4N3OS and molecular weight 369.00925 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[[2-(1,3-dichloro-1,1,3,3-tetrafluoro-2-hydroxypropan-2-yl)cyclohexylidene]amino]thiourea
Also Known As: NCI60_020876, [[2-(1,3-dichloro-1,1,3,3-tetrafluoro-2-hydroxy-propan-2-yl)cyclohexylidene]amino]thiourea, [[2-(1,3-Dichloro-1,1,3,3-Tetrafluoro-2-Hydroxy-Propan-2-ylCyclohexylidene]Amino]Thiourea, [[2-(1,3-dichloro-1,1,3,3-tetrafluoro-2-hydroxypropan-2-yl)cyclohexylidene]amino]thiourea
Technical Specifications
| Molecular Formula | C10H13Cl2F4N3OS |
| Molecular Weight | 369.00925 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.00925 Da |
| Heavy Atoms | 21 |
| Complexity | 436.0 |
| SMILES | C1CCC(=NNC(=S)N)C(C1)C(C(F)(F)Cl)(C(F)(F)Cl)O |
| InChIKey | AWCNYHYGKNOLOT-UHFFFAOYSA-N |
Chemical Property Profile of NCI60_020876
Property Insights of NCI60_020876
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NCI60_020876. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_020876. Following Lipinski's Rule of Five, NCI60_020876 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of NCI60_020876?
The CAS number of NCI60_020876 is 101564-41-4.
What is the molecular formula of NCI60_020876?
The molecular formula of NCI60_020876 is C10H13Cl2F4N3OS.
What is the molecular weight of NCI60_020876?
The molecular weight of NCI60_020876 is 369.00925 g/mol.
Where can I buy NCI60_020876?
You can request a quote for NCI60_020876 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for NCI60_020876?
Yes, CoreyChem provides custom synthesis services for NCI60_020876 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.