TL;DR: RefChem:322163 (CAS 151921-17-4) is a chemical compound with molecular formula C21H22N4O3 and molecular weight 378.1692 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2S)-1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-1-oxopropan-2-yl]benzamide
Also Known As: Benzamide, N-(2-((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)-1-methyl-2-oxoethyl)-, (S)-, N-[(2S)-1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-1-oxopropan-2-yl]benzamide, Benzamide,N-[2-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]-1-methyl-2-oxoethyl]-,(S)- (9CI), Benzamide,N-[2-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]-1-methyl-2-oxoethyl]-,(S)-(9CI), N-{(2S)-1-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]-1-hydroxypropan-2-yl}benzenecarboximidic acid
| Molecular Formula | C21H22N4O3 |
| Molecular Weight | 378.1692 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 81.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.1692 Da |
| Heavy Atoms | 28 |
| Complexity | 648.0 |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)[C@H](C)NC(=O)C3=CC=CC=C3 |
| InChIKey | SYYYSWYBNFXQPN-AWEZNQCLSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:322163. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:322163. Following Lipinski's Rule of Five, RefChem:322163 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:322163 is 151921-17-4.
The molecular formula of RefChem:322163 is C21H22N4O3.
The molecular weight of RefChem:322163 is 378.1692 g/mol.
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