TL;DR: Tambjamine I (CAS 157536-55-5) is a chemical compound with molecular formula C14H18BrN3O and molecular weight 323.06332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[5-(5-bromo-1H-pyrrol-2-yl)-3-methoxy-1H-pyrrol-2-yl]-N-(2-methylpropyl)methanimine
Also Known As: Tambjamine I, NCI60_023367, J2.534.770F, 1-Propanamine, N-[(Z)-[5-(5-bromo-1H-pyrrol-2-yl)-3-methoxy-2H-pyrrol-2-ylidene]methyl]-2-methyl-, ({5'-bromo-4-methoxy-1'H,5H-[2,2'-bipyrrol]-5-ylidene}methyl)(2-methylpropyl)amine
| Molecular Formula | C14H18BrN3O |
| Molecular Weight | 323.06332 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 53.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.06332 Da |
| Heavy Atoms | 19 |
| Complexity | 311.0 |
| SMILES | CC(C)CN=CC1=C(C=C(N1)C2=CC=C(N2)Br)OC |
| InChIKey | GGAUCNJADPWCIJ-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that Tambjamine I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.2 Ų, Tambjamine I exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tambjamine I has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Tambjamine I is 157536-55-5.
The molecular formula of Tambjamine I is C14H18BrN3O.
The molecular weight of Tambjamine I is 323.06332 g/mol.
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