TL;DR: 2-Buten-1-ol, 2-methyl-4-(1H-purin-6-ylamino)- (CAS 13114-27-7) is a chemical compound with molecular formula C10H13N5O and molecular weight 219.11201 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-4-(7H-purin-6-ylamino)but-2-en-1-ol
Also Known As: Zeatin, trans-Zeatin, cis-zeatin, Zeatin mixed isomers, Zeatin ribonucleoside
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H13N5O |
| Molecular Weight | 219.11201 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 86.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 219.11201 Da |
| Heavy Atoms | 16 |
| Complexity | 258.0 |
| SMILES | CC(=CCNC1=NC=NC2=C1NC=N2)CO |
| InChIKey | UZKQTCBAMSWPJD-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Buten-1-ol, 2-methyl-4-(1H-purin-6-ylamino)-. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Buten-1-ol, 2-methyl-4-(1H-purin-6-ylamino)-. Following Lipinski's Rule of Five, 2-Buten-1-ol, 2-methyl-4-(1H-purin-6-ylamino)- has 3 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 2-Buten-1-ol, 2-methyl-4-(1H-purin-6-ylamino)- is 13114-27-7.
The molecular formula of 2-Buten-1-ol, 2-methyl-4-(1H-purin-6-ylamino)- is C10H13N5O.
The molecular weight of 2-Buten-1-ol, 2-methyl-4-(1H-purin-6-ylamino)- is 219.11201 g/mol.
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