TL;DR: BAS 00641230 (CAS 153334-58-8) is a chemical compound with molecular formula C19H15N5O and molecular weight 329.12766 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-3-methyl-1-phenyl-4-pyridin-3-yl-4H-pyrano[3,2-d]pyrazole-5-carbonitrile
Also Known As: BAS 00641230, AB00075823-01, 6-amino-3-methyl-1-phenyl-4-(pyridin-3-yl)-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-3-methyl-1-phenyl-4-(pyridin-3-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, F1443-6021
| Molecular Formula | C19H15N5O |
| Molecular Weight | 329.12766 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 89.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 329.12766 Da |
| Heavy Atoms | 25 |
| Complexity | 576.0 |
| SMILES | CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CN=CC=C3)C4=CC=CC=C4 |
| InChIKey | RRUXMTZKNWIJSQ-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00641230. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00641230. Following Lipinski's Rule of Five, BAS 00641230 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 BAS 00641230 is 153334-58-8.
The molecular formula of BAS 00641230 is C19H15N5O.
The molecular weight of BAS 00641230 is 329.12766 g/mol.
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