TL;DR: 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide (CAS 1147188-18-8) is a chemical compound with molecular formula C18H15N5O3 and molecular weight 349.1175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-oxo-N-(4-phenoxyphenyl)-6,7-dihydro-4H-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Also Known As: 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide, 5-hydroxy-N-(4-phenoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide, 5-oxo-N-(4-phenoxyphenyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide, (5-oxo(4,6,7,8-tetrahydro-1,2,4-triazolo[1,5-a]pyrimidin-7-yl))-N-(4-phenoxyph enyl)carboxamide, 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
| Molecular Formula | C18H15N5O3 |
| Molecular Weight | 349.1175 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 98.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.1175 Da |
| Heavy Atoms | 26 |
| Complexity | 517.0 |
| SMILES | C1C(N2C(=NC=N2)NC1=O)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4 |
| InChIKey | KYLBOIWQRKALBK-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide. Following Lipinski's Rule of Five, 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide is 1147188-18-8.
The molecular formula of 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide is C18H15N5O3.
The molecular weight of 5-oxo-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide is 349.1175 g/mol.
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