TL;DR: Norbinaltorphimine (CAS 113158-34-2) is a chemical compound with molecular formula C40H43N3O6 and molecular weight 661.3152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,2S,7S,8S,12R,20R,24R,32R)-11,33-bis(cyclopropylmethyl)-19,25-dioxa-11,22,33-triazaundecacyclo[24.9.1.18,14.01,24.02,32.04,23.05,21.07,12.08,20.030,36.018,37]heptatriaconta-4(23),5(21),14(37),15,17,26,28,30(36)-octaene-2,7,17,27-tetrol
Also Known As: Norbinaltorphimine, nor-Binaltorphimine, Nor-bni, NorBNI, nor-Binaltorphimine dihydrochloride
| Molecular Formula | C40H43N3O6 |
| Molecular Weight | 661.3152 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 122.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 661.3152 Da |
| Heavy Atoms | 49 |
| Complexity | 1340.0 |
| SMILES | C1CC1CN2CC[C@]34[C@@H]5C6=C(C[C@]3([C@H]2CC7=C4C(=C(C=C7)O)O5)O)C8=C(N6)[C@H]9[C@@]12CCN([C@@H]([C@@]1(C8)O)CC1=C2C(=C(C=C1)O)O9)CC1CC1 |
| InChIKey | APSUXPSYBJVPPS-YAUKWVCOSA-N |
The XLogP value of 3.2 indicates that Norbinaltorphimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Norbinaltorphimine. Following Lipinski's Rule of Five, Norbinaltorphimine has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Norbinaltorphimine is 113158-34-2.
The molecular formula of Norbinaltorphimine is C40H43N3O6.
The molecular weight of Norbinaltorphimine is 661.3152 g/mol.
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