TL;DR: 2-Hydroxymethyl-4-(4-(N,N-dimethylaminosulfonyl)-1-piperazino)pyrimidine (CAS 140687-51-0) is a chemical compound with molecular formula C11H19N5O3S and molecular weight 301.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-(hydroxymethyl)pyrimidin-4-yl]-N,N-dimethylpiperazine-1-sulfonamide
Also Known As: Sdi-2 cpd, Way 135706, 4-[2-(HYDROXYMETHYL)PYRIMIDIN-4-YL]-N,N-DIMETHYLPIPERAZINE-1-SULFONAMIDE, CP 166572, CP166,572
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H19N5O3S |
| Molecular Weight | 301.12085 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 98.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.12085 Da |
| Heavy Atoms | 20 |
| Complexity | 403.0 |
| SMILES | CN(C)S(=O)(=O)N1CCN(CC1)C2=NC(=NC=C2)CO |
| InChIKey | XDTHNROWHAAVPJ-UHFFFAOYSA-N |
The XLogP value of -1.2 indicates that 2-Hydroxymethyl-4-(4-(N,N-dimethylaminosulfonyl)-1-piperazino)pyrimidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxymethyl-4-(4-(N,N-dimethylaminosulfonyl)-1-piperazino)pyrimidine. Following Lipinski's Rule of Five, 2-Hydroxymethyl-4-(4-(N,N-dimethylaminosulfonyl)-1-piperazino)pyrimidine has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Hydroxymethyl-4-(4-(N,N-dimethylaminosulfonyl)-1-piperazino)pyrimidine is 140687-51-0.
The molecular formula of 2-Hydroxymethyl-4-(4-(N,N-dimethylaminosulfonyl)-1-piperazino)pyrimidine is C11H19N5O3S.
The molecular weight of 2-Hydroxymethyl-4-(4-(N,N-dimethylaminosulfonyl)-1-piperazino)pyrimidine is 301.12085 g/mol.
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