TL;DR: KF 14124 (CAS 134186-26-8) is a chemical compound with molecular formula C19H27N3O5S and molecular weight 409.16714 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3S,3aR,6S,6aS)-3-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate
Also Known As: Dptpp-2-ismn, KF 14124, SID:134223516, 5-Deoxy-5-(4-(3-phenylthiopropyl)piperazin-1-yl)-1,4:3,6-dianhydro-L-iditol 2-nitrate dihydrochloride, [(3S,3aR,6S,6aS)-3-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate
| Molecular Formula | C19H27N3O5S |
| Molecular Weight | 409.16714 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.16714 Da |
| Heavy Atoms | 28 |
| Complexity | 508.0 |
| SMILES | C1CN(CCN1CCCSC2=CC=CC=C2)[C@H]3CO[C@H]4[C@@H]3OC[C@@H]4O[N+](=O)[O-] |
| InChIKey | IHHFECHILHHROD-INDMIFKZSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KF 14124. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KF 14124. Following Lipinski's Rule of Five, KF 14124 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of KF 14124 is 134186-26-8.
The molecular formula of KF 14124 is C19H27N3O5S.
The molecular weight of KF 14124 is 409.16714 g/mol.
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