TL;DR: N-[4-(aminosulfonyl)benzyl]-4-oxo-4H-chromene-2-carboxamide (CAS 878467-54-0) is a chemical compound with molecular formula C17H14N2O5S and molecular weight 358.06235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-oxo-N-[(4-sulfamoylphenyl)methyl]chromene-2-carboxamide
Also Known As: N-[4-(aminosulfonyl)benzyl]-4-oxo-4H-chromene-2-carboxamide, 4-oxo-N-(4-sulfamoylbenzyl)-4H-chromene-2-carboxamide, 4-oxo-N-[(4-sulfamoylphenyl)methyl]chromene-2-carboxamide, 4-Oxo-N-[(4-sulfamoylphenyl)methyl]-4H-1-benzopyran-2-carboxamide, 4-OXO-N-[(4-SULFAMOYLPHENYL)METHYL]-4H-CHROMENE-2-CARBOXAMIDE
| Molecular Formula | C17H14N2O5S |
| Molecular Weight | 358.06235 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.06235 Da |
| Heavy Atoms | 25 |
| Complexity | 659.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N |
| InChIKey | REKMRLGIBSBGID-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(aminosulfonyl)benzyl]-4-oxo-4H-chromene-2-carboxamide. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(aminosulfonyl)benzyl]-4-oxo-4H-chromene-2-carboxamide. Following Lipinski's Rule of Five, N-[4-(aminosulfonyl)benzyl]-4-oxo-4H-chromene-2-carboxamide has 2 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 N-[4-(aminosulfonyl)benzyl]-4-oxo-4H-chromene-2-carboxamide is 878467-54-0.
The molecular formula of N-[4-(aminosulfonyl)benzyl]-4-oxo-4H-chromene-2-carboxamide is C17H14N2O5S.
The molecular weight of N-[4-(aminosulfonyl)benzyl]-4-oxo-4H-chromene-2-carboxamide is 358.06235 g/mol.
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