TL;DR: BAS 00297193 (CAS 132038-93-8) is a chemical compound with molecular formula C13H23N9 and molecular weight 305.20764 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-N-tert-butyl-2-N,6-N-diethyl-2-N-(1,2,4-triazol-4-yl)-1,3,5-triazine-2,4,6-triamine
Also Known As: BAS 00297193, 4-N-tert-butyl-2-N,6-N-diethyl-2-N-(1,2,4-triazol-4-yl)-1,3,5-triazine-2,4,6-triamine, N-tert-Butyl-N',N''-diethyl-N'-[1,2,4]triazol-4-yl-[1,3,5]triazine-2,4,6-triamine, [4-(tert-butylamino)-6-(ethylamino)-s-triazin-2-yl]-ethyl-(1,2,4-triazol-4-yl)amine, N4-tert-butyl-N2,N6-diethyl-N2-(1,2,4-triazol-4-yl)-1,3,5-triazine-2,4,6-triamine
| Molecular Formula | C13H23N9 |
| Molecular Weight | 305.20764 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 96.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 305.20764 Da |
| Heavy Atoms | 22 |
| Complexity | 326.0 |
| SMILES | CCNC1=NC(=NC(=N1)N(CC)N2C=NN=C2)NC(C)(C)C |
| InChIKey | IVICYBOWSBXURO-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00297193. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00297193. Following Lipinski's Rule of Five, BAS 00297193 has 2 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 BAS 00297193 is 132038-93-8.
The molecular formula of BAS 00297193 is C13H23N9.
The molecular weight of BAS 00297193 is 305.20764 g/mol.
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