TL;DR: 3-Thiophenecarboxamide, N-(2-bromophenyl)-5-nitro- (CAS 146795-43-9) is a chemical compound with molecular formula C11H7BrN2O3S and molecular weight 325.93607 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-bromophenyl)-5-nitrothiophene-3-carboxamide
Also Known As: N-(2-Bromophenyl)-5-nitro-3-thiophenecarboxamide, 3-Thiophenecarboxamide, N-(2-bromophenyl)-5-nitro-, N-(2-bromophenyl)-5-nitrothiophene-3-carboxamide, CCRIS 6464
| Molecular Formula | C11H7BrN2O3S |
| Molecular Weight | 325.93607 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.93607 Da |
| Heavy Atoms | 18 |
| Complexity | 337.0 |
| SMILES | C1=CC=C(C(=C1)NC(=O)C2=CSC(=C2)[N+](=O)[O-])Br |
| InChIKey | OPZVDHFGSSWKIJ-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 3-Thiophenecarboxamide, N-(2-bromophenyl)-5-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Thiophenecarboxamide, N-(2-bromophenyl)-5-nitro-. Following Lipinski's Rule of Five, 3-Thiophenecarboxamide, N-(2-bromophenyl)-5-nitro- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Thiophenecarboxamide, N-(2-bromophenyl)-5-nitro- is 146795-43-9.
The molecular formula of 3-Thiophenecarboxamide, N-(2-bromophenyl)-5-nitro- is C11H7BrN2O3S.
The molecular weight of 3-Thiophenecarboxamide, N-(2-bromophenyl)-5-nitro- is 325.93607 g/mol.
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