TL;DR: 25,26,27,28-Tetrapropoxycalix[4]arene (CAS 147782-22-7) is a chemical compound with molecular formula C40H48O4 and molecular weight 592.3553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
25,26,27,28-tetrapropoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15,17,19(26),21,23-dodecaene
Also Known As: 25,26,27,28-Tetrapropoxycalix[4]arene, 25,26,27,28-TETRAPROPOXYCALIX[4!ARENE, 98, F1170-0236, 12,32,52,72-Tetrapropoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane, 25,26,27,28-tetrapropoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15,17,19(26),21,23-dodecaene
| Molecular Formula | C40H48O4 |
| Molecular Weight | 592.3553 g/mol |
| XLogP | 11.1 |
| Topological Polar Surface Area (TPSA) | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 592.3553 Da |
| Heavy Atoms | 44 |
| Complexity | 619.0 |
| SMILES | CCCOC1=C2CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=CC=CC(=C5OCCC)CC1=CC=C2)OCCC)OCCC |
| InChIKey | YDRMWZTYFKKFIT-UHFFFAOYSA-N |
The XLogP value of 11.1 indicates that 25,26,27,28-Tetrapropoxycalix[4]arene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.9 Ų, 25,26,27,28-Tetrapropoxycalix[4]arene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 25,26,27,28-Tetrapropoxycalix[4]arene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 25,26,27,28-Tetrapropoxycalix[4]arene is 147782-22-7.
The molecular formula of 25,26,27,28-Tetrapropoxycalix[4]arene is C40H48O4.
The molecular weight of 25,26,27,28-Tetrapropoxycalix[4]arene is 592.3553 g/mol.
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