TL;DR: (3-(1-allyl-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl)(thiophen-2-ylsulfonyl)amide (CAS 1264300-15-3) is a chemical compound with molecular formula C18H15N5O2S2 and molecular weight 397.0667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(3-prop-2-enylimidazol-3-ium-1-yl)quinoxalin-2-yl]-thiophen-2-ylsulfonylazanide
Also Known As: (3-(1-allyl-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl)(thiophen-2-ylsulfonyl)amide, VU0352604-2, F3225-0737, N-[3-(3-prop-2-enylimidazol-3-ium-1-yl)quinoxalin-2-yl]thiophene-2-sulfonimidate, 3-(prop-2-en-1-yl)-1-{3-[(thiophene-2-sulfonyl)azanidyl]quinoxalin-2-yl}-3H-1lambda5-imidazol-1-ylium
| Molecular Formula | C18H15N5O2S2 |
| Molecular Weight | 397.0667 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.0667 Da |
| Heavy Atoms | 27 |
| Complexity | 626.0 |
| SMILES | C=CC[N+]1=CN(C=C1)C2=NC3=CC=CC=C3N=C2[N-]S(=O)(=O)C4=CC=CS4 |
| InChIKey | REDODOAASOUDEO-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that (3-(1-allyl-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl)(thiophen-2-ylsulfonyl)amide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-(1-allyl-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl)(thiophen-2-ylsulfonyl)amide. Following Lipinski's Rule of Five, (3-(1-allyl-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl)(thiophen-2-ylsulfonyl)amide has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (3-(1-allyl-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl)(thiophen-2-ylsulfonyl)amide is 1264300-15-3.
The molecular formula of (3-(1-allyl-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl)(thiophen-2-ylsulfonyl)amide is C18H15N5O2S2.
The molecular weight of (3-(1-allyl-1H-imidazol-3-ium-3-yl)quinoxalin-2-yl)(thiophen-2-ylsulfonyl)amide is 397.0667 g/mol.
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