TL;DR: AP-906/42126981 (CAS 540507-10-6) is a chemical compound with molecular formula C24H25N5O5 and molecular weight 463.18558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(1,3-benzodioxol-5-yl)-2-(3-hydroxypropyl)-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Also Known As: AP-906/42126981, F1264-5916, 7-(1,3-benzodioxol-5-yl)-2-(3-hydroxypropyl)-N-(2-methoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 7-(1,3-benzodioxol-5-yl)-2-(3-hydroxypropyl)-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 7-(1,3-Benzodioxol-5-yl)-2-(3-hydroxypropyl)-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
| Molecular Formula | C24H25N5O5 |
| Molecular Weight | 463.18558 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.18558 Da |
| Heavy Atoms | 34 |
| Complexity | 766.0 |
| SMILES | CC1=C(C(N2C(=NC(=N2)CCCO)N1)C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC=CC=C5OC |
| InChIKey | AMQURPUIZCYQFH-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AP-906/42126981. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-906/42126981. Following Lipinski's Rule of Five, AP-906/42126981 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 AP-906/42126981 is 540507-10-6.
The molecular formula of AP-906/42126981 is C24H25N5O5.
The molecular weight of AP-906/42126981 is 463.18558 g/mol.
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