TL;DR: 4-(4-Bromophenyl)-2-pyrrolidinyl-1,3-thiazole (CAS 152819-73-3) is a chemical compound with molecular formula C13H13BrN2S and molecular weight 307.9983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-bromophenyl)-2-pyrrolidin-1-yl-1,3-thiazole
Also Known As: Thiazole, 4-(4-bromophenyl)-2-(1-pyrrolidinyl)-, 4-(4-bromophenyl)-2-pyrrolidinyl-1,3-thiazole, 4-(4-bromophenyl)-2-pyrrolidin-1-yl-1,3-thiazole, 4-(4-bromophenyl)-2-(1-pyrrolidinyl)-1,3-thiazole
| Molecular Formula | C13H13BrN2S |
| Molecular Weight | 307.9983 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 44.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.9983 Da |
| Heavy Atoms | 17 |
| Complexity | 250.0 |
| SMILES | C1CCN(C1)C2=NC(=CS2)C3=CC=C(C=C3)Br |
| InChIKey | IRARKVLHMVETPL-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that 4-(4-Bromophenyl)-2-pyrrolidinyl-1,3-thiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.4 Ų, 4-(4-Bromophenyl)-2-pyrrolidinyl-1,3-thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Bromophenyl)-2-pyrrolidinyl-1,3-thiazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(4-Bromophenyl)-2-pyrrolidinyl-1,3-thiazole is 152819-73-3.
The molecular formula of 4-(4-Bromophenyl)-2-pyrrolidinyl-1,3-thiazole is C13H13BrN2S.
The molecular weight of 4-(4-Bromophenyl)-2-pyrrolidinyl-1,3-thiazole is 307.9983 g/mol.
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