TL;DR: RefChem:237097 (CAS 14321-01-8) is a chemical compound with molecular formula C14H17BN4O2 and molecular weight 284.14447 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,4,6-tetramethyl-2-phenyl-[1,3,2]diazaborolo[4,5-d]pyrimidine-5,7-dione
Also Known As: 1H-1,3,2-Diazaborolo(4,5-d)pyrimidine-5,7(4H,6H)-dione, 2,3-dihydro-2-phenyl-1,3,4,6-tetramethyl-, 1,3,4,6-tetramethyl-2-phenyl-[1,3,2]diazaborolo[4,5-d]pyrimidine-5,7-dione, 1,3,4,6-Tetramethyl-2-phenyl-2,3-dihydro-1H-[1,3,2]diazaborolo[4,5-d]pyrimidine-5,7(4H,6H)-dione, BRN 0564553
| Molecular Formula | C14H17BN4O2 |
| Molecular Weight | 284.14447 g/mol |
| XLogP | -0.6346 |
| Topological Polar Surface Area (TPSA) | 47.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 284.14447 Da |
| Heavy Atoms | 21 |
| Complexity | 515.0 |
| SMILES | B1(N(C2=C(N1C)N(C(=O)N(C2=O)C)C)C)C3=CC=CC=C3 |
| InChIKey | WOKNDINWSUVFTO-UHFFFAOYSA-N |
The XLogP value of -0.6346 indicates that RefChem:237097 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 47.1 Ų, RefChem:237097 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:237097 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:237097 is 14321-01-8.
The molecular formula of RefChem:237097 is C14H17BN4O2.
The molecular weight of RefChem:237097 is 284.14447 g/mol.
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