TL;DR: 2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-2-propenyl- (CAS 106691-36-5) is a chemical compound with molecular formula C13H14N2O2S and molecular weight 262.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-oxo-4H-1,4-benzothiazin-2-yl)-N-prop-2-enylacetamide
Also Known As: 2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-2-propenyl-, 2-(3-oxo-4H-1,4-benzothiazin-2-yl)-N-prop-2-enylacetamide, F3205-0050, 2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)-N-(prop-2-en-1-yl)acetamide, 3,4-Dihydro-3-oxo-N-2-propen-1-yl-2H-1,4-benzothiazine-2-acetamide
| Molecular Formula | C13H14N2O2S |
| Molecular Weight | 262.0776 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.0776 Da |
| Heavy Atoms | 18 |
| Complexity | 346.0 |
| SMILES | C=CCNC(=O)CC1C(=O)NC2=CC=CC=C2S1 |
| InChIKey | RVWKHQHHBJFJNL-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-2-propenyl-. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-2-propenyl-. Following Lipinski's Rule of Five, 2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-2-propenyl- has 2 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 2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-2-propenyl- is 106691-36-5.
The molecular formula of 2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-2-propenyl- is C13H14N2O2S.
The molecular weight of 2H-1,4-Benzothiazine-2-acetamide, 3,4-dihydro-3-oxo-N-2-propenyl- is 262.0776 g/mol.
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