TL;DR: N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide (CAS 152877-85-5) is a chemical compound with molecular formula C10H15NO4S and molecular weight 245.07217 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide
Also Known As: 2-(Tosylamino)propane-1,3-diol, J2.423.081C, N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide, N-(1,3-dihydroxypropan-2-yl)-4-methyl-benzenesulfonamide, N-(1,3-dihydroxypropan-2-yl)-4-methylbenzene-1-sulfonamide
| Molecular Formula | C10H15NO4S |
| Molecular Weight | 245.07217 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 95.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 245.07217 Da |
| Heavy Atoms | 16 |
| Complexity | 286.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(CO)CO |
| InChIKey | RIBXKYJQUGWPJT-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide. The TPSA of 95.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide is 152877-85-5.
The molecular formula of N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide is C10H15NO4S.
The molecular weight of N-(1,3-dihydroxypropan-2-yl)-4-methylbenzenesulfonamide is 245.07217 g/mol.
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