TL;DR: Benzamide, N-antipyrinyl-p-iodo-N-isopropyl- (CAS 81217-11-0) is a chemical compound with molecular formula C21H22IN3O2 and molecular weight 475.07568 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-iodo-N-propan-2-ylbenzamide
Also Known As: N-Antipyrinyl-p-iodo-N-isopropylbenzamide, BENZAMIDE, N-ANTIPYRINYL-p-IODO-N-ISOPROPYL-, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-iodo-N-propan-2-ylbenzamide, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-iodo-N-(propan-2-yl)benzamide, Benzamide,N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-4-iodo-N-(1-methylethyl)-
| Molecular Formula | C21H22IN3O2 |
| Molecular Weight | 475.07568 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 43.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 475.07568 Da |
| Heavy Atoms | 27 |
| Complexity | 605.0 |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C(C)C)C(=O)C3=CC=C(C=C3)I |
| InChIKey | TZLFDRYOKPGXMU-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that Benzamide, N-antipyrinyl-p-iodo-N-isopropyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.9 Ų, Benzamide, N-antipyrinyl-p-iodo-N-isopropyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzamide, N-antipyrinyl-p-iodo-N-isopropyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzamide, N-antipyrinyl-p-iodo-N-isopropyl- is 81217-11-0.
The molecular formula of Benzamide, N-antipyrinyl-p-iodo-N-isopropyl- is C21H22IN3O2.
The molecular weight of Benzamide, N-antipyrinyl-p-iodo-N-isopropyl- is 475.07568 g/mol.
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