TL;DR: BAS 00337984 (CAS 57450-62-1) is a chemical compound with molecular formula C60H62N4O4 and molecular weight 902.4771 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,10,15,20-tetrakis(4-butoxyphenyl)-21,22-dihydroporphyrin
Also Known As: BAS 00337984, 5,10,15,20-Tetrakis(4-butoxyphenyl)-Porphine, 5,10,15,20-Tetrakis(4-butoxyphenyl)porphyrin, 5,10,15,20-tetrakis(4-butoxyphenyl)-21,22-dihydroporphyrin
| Molecular Formula | C60H62N4O4 |
| Molecular Weight | 902.4771 g/mol |
| XLogP | 15.3 |
| Topological Polar Surface Area (TPSA) | 94.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 20 |
| Exact Mass | 902.4771 Da |
| Heavy Atoms | 68 |
| Complexity | 1330.0 |
| SMILES | CCCCOC1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)OCCCC)C8=CC=C(C=C8)OCCCC)C9=CC=C(C=C9)OCCCC)N3 |
| InChIKey | YKKLTLVFXBUIBT-UHFFFAOYSA-N |
The XLogP value of 15.3 indicates that BAS 00337984 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00337984. Following Lipinski's Rule of Five, BAS 00337984 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of BAS 00337984 is 57450-62-1.
The molecular formula of BAS 00337984 is C60H62N4O4.
The molecular weight of BAS 00337984 is 902.4771 g/mol.
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