TL;DR: 5-(4-Bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine (CAS 487023-91-6) is a chemical compound with molecular formula C14H10BrN5O and molecular weight 343.00687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine
Also Known As: 5-(4-bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine, AE-848/41538875, 5-(4-bromophenyl)-7-(furan-2-yl)-1,7-dihydrotetrazolo[1,5-a]pyrimidine, 5-(4-Bromo-phenyl)-7-furan-2-yl-4,7-dihydro-tetrazolo[1,5-a]pyrimidine, 5-(4-bromophenyl)-7-(2-furyl)-4,7-dihydrotetraazolo[1,5-a]pyrimidine
| Molecular Formula | C14H10BrN5O |
| Molecular Weight | 343.00687 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 68.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.00687 Da |
| Heavy Atoms | 21 |
| Complexity | 412.0 |
| SMILES | C1=COC(=C1)C2C=C(NC3=NN=NN23)C4=CC=C(C=C4)Br |
| InChIKey | ABMQAURIRUUZLZ-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that 5-(4-Bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine. Following Lipinski's Rule of Five, 5-(4-Bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine has 1 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-(4-Bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine is 487023-91-6.
The molecular formula of 5-(4-Bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine is C14H10BrN5O.
The molecular weight of 5-(4-Bromophenyl)-7-(furan-2-yl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine is 343.00687 g/mol.
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