TL;DR: Piperazine 1Pyrid 4Indolyl deriv. (CAS 147920-15-8) is a chemical compound with molecular formula C23H25F3N6O2 and molecular weight 474.1991 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,2-trifluoro-N-[2-[4-[3-(propan-2-ylamino)-2-pyridinyl]piperazine-1-carbonyl]-1H-indol-5-yl]acetamide
Also Known As: Piperazine 1Pyrid 4Indolyl deriv., 5- or 6-Substituted Indole BHAP analogue 19, 1-((5-(Trifluoroacetylamino)-2-indolyl)carbonyl)-4-(3-(isopropylamino)-2-pyridinyl)piperazine, 1-[[5-(Trifluoroacetylamino)-2-indolyl]carbonyl]-4-[3-(isopropylamino)-2-pyridinyl]piperazine, 2,2,2-trifluoro-N-[2-({4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin-1-yl}carbonyl)-1H-indol-5-yl]acetamide
| Molecular Formula | C23H25F3N6O2 |
| Molecular Weight | 474.1991 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 93.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.1991 Da |
| Heavy Atoms | 34 |
| Complexity | 728.0 |
| SMILES | CC(C)NC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)NC(=O)C(F)(F)F |
| InChIKey | IQWZRCANSWEHQR-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that Piperazine 1Pyrid 4Indolyl deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperazine 1Pyrid 4Indolyl deriv.. Following Lipinski's Rule of Five, Piperazine 1Pyrid 4Indolyl deriv. has 3 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 Piperazine 1Pyrid 4Indolyl deriv. is 147920-15-8.
The molecular formula of Piperazine 1Pyrid 4Indolyl deriv. is C23H25F3N6O2.
The molecular weight of Piperazine 1Pyrid 4Indolyl deriv. is 474.1991 g/mol.
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