TL;DR: N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide (CAS 1009520-94-8) is a chemical compound with molecular formula C23H31N3O3S and molecular weight 429.20862 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide
Also Known As: N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide, N-[1-(4-benzylpiperazin-1-yl)-1-oxo-propan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide
| Molecular Formula | C23H31N3O3S |
| Molecular Weight | 429.20862 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 69.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.20862 Da |
| Heavy Atoms | 30 |
| Complexity | 664.0 |
| SMILES | CC1=C(C=C(C=C1)N(C(C)C(=O)N2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)C)C |
| InChIKey | NZWSALOLLHZZCH-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide. Following Lipinski's Rule of Five, N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide has 0 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-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide is 1009520-94-8.
The molecular formula of N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide is C23H31N3O3S.
The molecular weight of N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(3,4-dimethylphenyl)methanesulfonamide is 429.20862 g/mol.
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