TL;DR: PD 151242 (CAS 155561-67-4) is a chemical compound with molecular formula C34H45N5O6 and molecular weight 619.337 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[[(2R)-2-[[(2S)-2-(azepane-1-carbonylamino)-4-methylpentanoyl]amino]-3-(1-methylindol-3-yl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Also Known As: PD 151,242, PD 151242, [125I]PD151242, N-((Hexahydro-1-azepinyl)carbonyl)-leucyl(1-methyl)-tryptophyl-tryptophan, [125I]-PD151242
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C34H45N5O6 |
| Molecular Weight | 619.337 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 619.337 Da |
| Heavy Atoms | 45 |
| Complexity | 994.0 |
| SMILES | CC(C)C[C@@H](C(=O)N[C@H](CC1=CN(C2=CC=CC=C21)C)C(=O)N[C@H](CC3=CC=C(C=C3)O)C(=O)O)NC(=O)N4CCCCCC4 |
| InChIKey | JVILFANCFWZBFU-ZGIBFIJWSA-N |
The XLogP value of 4.5 indicates that PD 151242 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.0 Ų indicates high polarity, suggesting PD 151242 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PD 151242 has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of PD 151242 is 155561-67-4.
The molecular formula of PD 151242 is C34H45N5O6.
The molecular weight of PD 151242 is 619.337 g/mol.
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