PKI 166
TL;DR: PKI 166 (CAS 1350639-79-0) is a chemical compound with molecular formula C20H18N4O and molecular weight 330.14807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[4-[[(1R)-1-phenylethyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenol
Also Known As: PKI 166, PKI166, NVP-PKI166, CGP 75166, PKI 166 [WHO-DD]
Technical Specifications
| Molecular Formula | C20H18N4O |
| Molecular Weight | 330.14807 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 73.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.14807 Da |
| Heavy Atoms | 25 |
| Complexity | 420.0 |
| SMILES | C[C@H](C1=CC=CC=C1)NC2=NC=NC3=C2C=C(N3)C4=CC=C(C=C4)O |
| InChIKey | XRYJULCDUUATMC-CYBMUJFWSA-N |
Chemical Property Profile of PKI 166
Property Insights of PKI 166
The XLogP value of 4.2 indicates that PKI 166 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for PKI 166. Following Lipinski's Rule of Five, PKI 166 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of PKI 166?
The CAS number of PKI 166 is 1350639-79-0.
What is the molecular formula of PKI 166?
The molecular formula of PKI 166 is C20H18N4O.
What is the molecular weight of PKI 166?
The molecular weight of PKI 166 is 330.14807 g/mol.
Where can I buy PKI 166?
You can request a quote for PKI 166 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PKI 166?
Yes, CoreyChem provides custom synthesis services for PKI 166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.