TL;DR: NVP-TAE 226 (CAS 1042432-58-5) is a chemical compound with molecular formula C23H25ClN6O3 and molecular weight 468.16766 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-chloro-2-(2-methoxy-4-morpholin-4-ylanilino)pyrimidin-4-yl]amino]-N-methylbenzamide
Also Known As: NVP-TAE 226, NVP-TAE226, TAE226, 2jkk, TAE226 (NVP-TAE226)
| Molecular Formula | C23H25ClN6O3 |
| Molecular Weight | 468.16766 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 468.16766 Da |
| Heavy Atoms | 33 |
| Complexity | 625.0 |
| SMILES | CNC(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=C(C=C(C=C3)N4CCOCC4)OC |
| InChIKey | UYJNQQDJUOUFQJ-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that NVP-TAE 226 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NVP-TAE 226. Following Lipinski's Rule of Five, NVP-TAE 226 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of NVP-TAE 226 is 1042432-58-5.
The molecular formula of NVP-TAE 226 is C23H25ClN6O3.
The molecular weight of NVP-TAE 226 is 468.16766 g/mol.
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