TL;DR: Avanafil (CAS 647841-09-6) is a chemical compound with molecular formula C23H26ClN7O3 and molecular weight 483.17856 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide
Also Known As: Avanafil, Spedra, STENDRA, Avanafilo, avanafilum
| Molecular Formula | C23H26ClN7O3 |
| Molecular Weight | 483.17856 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 483.17856 Da |
| Heavy Atoms | 34 |
| Complexity | 642.0 |
| SMILES | COC1=C(C=C(C=C1)CNC2=NC(=NC=C2C(=O)NCC3=NC=CC=N3)N4CCC[C@H]4CO)Cl |
| InChIKey | WEAJZXNPAWBCOA-INIZCTEOSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Avanafil. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Avanafil. Following Lipinski's Rule of Five, Avanafil has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Avanafil is 647841-09-6.
The molecular formula of Avanafil is C23H26ClN7O3.
The molecular weight of Avanafil is 483.17856 g/mol.
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