TL;DR: 14-Bciihh (CAS 134916-12-4) is a chemical compound with molecular formula C38H56N2O9 and molecular weight 684.39856 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3S,4R)-4-methyl-2-[(4R,5R)-2,2,5-trimethyl-5-[2-[(6S)-5-methyl-2-oxo-6-[3-(phenylmethoxymethoxy)pentan-2-yl]-1,3-dioxan-4-yl]propyl]-1,3-dioxolan-4-yl]hex-5-en-3-yl] imidazole-1-carboxylate
Also Known As: 14-Bciihh, [(3S,4R)-4-methyl-2-[(4R,5R)-2,2,5-trimethyl-5-[2-[(6S)-5-methyl-2-oxo-6-[3-(phenylmethoxymethoxy)pentan-2-yl]-1,3-dioxan-4-yl]propyl]-1,3-dioxolan-4-yl]hex-5-en-3-yl] imidazole-1-carboxylate, 14-Benzyloxymethoxy-10,12-O-carbonyl-4-N-imidazolylcarbonyl-6,7-isopropylidene-3,5,7,9,11,13-hexamethylhexadec-1-ene-4,6,7,10,12,14-hexol, 1-Isopropyl-6-oxo-1,6-dihydropyridine-3-boronic Acid Pinacol Ester, 1H-Imidazole-1-carboxylic acid, 2-methyl-1-(1-(2,2,5-trimethyl-5-(2-(5-methyl-6-(1-methyl-2-((phenylmethoxy)methoxy)butyl)-2-oxo-1,3-dioxan-4-yl)propyl)-1,3-dioxolan-4-yl)ethyl)-3-butenyl ester, (4S-(4alpha(S*(4S*(R*(1S*,2R*)),5S*)),4abeta,6beta(1R*,2S*)))-
| Molecular Formula | C38H56N2O9 |
| Molecular Weight | 684.39856 g/mol |
| XLogP | 8.3 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 17 |
| Exact Mass | 684.39856 Da |
| Heavy Atoms | 49 |
| Complexity | 1080.0 |
| SMILES | CCC(C(C)[C@H]1C(C(OC(=O)O1)C(C)C[C@@]2([C@H](OC(O2)(C)C)C(C)[C@H]([C@H](C)C=C)OC(=O)N3C=CN=C3)C)C)OCOCC4=CC=CC=C4 |
| InChIKey | JPSFXYCZTMSVTR-RMPQWPRUSA-N |
The XLogP value of 8.3 indicates that 14-Bciihh is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 14-Bciihh. Following Lipinski's Rule of Five, 14-Bciihh has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 14-Bciihh is 134916-12-4.
The molecular formula of 14-Bciihh is C38H56N2O9.
The molecular weight of 14-Bciihh is 684.39856 g/mol.
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