TL;DR: Neopyrrolomycin (CAS 131956-34-8) is a chemical compound with molecular formula C10H4Cl5NO and molecular weight 328.87357 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4,5-trichloro-2-(2,3-dichloropyrrol-1-yl)phenol
Also Known As: Neopyrrolomycin, (+)-Neopyrrolomycin, Antibiotic MI-424-38F1, 3,4,5-trichloro-2-(2,3-dichloropyrrol-1-yl)phenol, 2-(2,3-Dichloro-1H-pyrrol-1-yl)-3,4,5-trichlorophenol
| Molecular Formula | C10H4Cl5NO |
| Molecular Weight | 328.87357 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 25.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.87357 Da |
| Heavy Atoms | 17 |
| Complexity | 281.0 |
| SMILES | C1=CN(C(=C1Cl)Cl)C2=C(C(=C(C=C2O)Cl)Cl)Cl |
| InChIKey | VQUHAXJBUPCVDX-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that Neopyrrolomycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.2 Ų, Neopyrrolomycin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Neopyrrolomycin has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Neopyrrolomycin is 131956-34-8.
The molecular formula of Neopyrrolomycin is C10H4Cl5NO.
The molecular weight of Neopyrrolomycin is 328.87357 g/mol.
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