Binaltorphimine
TL;DR: Binaltorphimine (CAS 105618-27-7) is a chemical compound with molecular formula C41H45N3O6 and molecular weight 675.3308 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)-22-methyl-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: Binaltorphimine, Bni ligand, (1S,2S,7S,8S,12R,20R,24R,32R)-11,33-bis(cyclopropylmethyl)-22-methyl-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, (4BS,8R,8AS,10AS,11R,14AS,19AR,20BR)-7,12-BIS(CYCLOPROPYLMETHYL)-5,6,7,8,9,10,11,12,13,14,19A,20B-DODECAHYDRO-20-METHYL-4,8:11,15-DIMETHANO-20H-BISBENZOFURO(2,3-A:3',2'-I)DIPYRIDO(4,3-B:3',4'-H)CARBAZOLE-1,8A,10A,18-TETROL, 4,8:11,15-Dimethano-20H-bisbenzofuro(2,3-a:3',2'-i)dipyrido(4,3-b:3',4'-h)carbazole-1,8a,10a,18-tetrol, 7,12-bis(cyclopropylmethyl)-5,6,7,8,9,10,11,12,13,14,19a,20b-dodecahydro-20-methyl-, (8R-(4bS*,8alpha,8abeta,10aalpha,11beta,14aS*,19aalpha,20bbeta))-
Technical Specifications
| Molecular Formula | C41H45N3O6 |
| Molecular Weight | 675.3308 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 675.3308 Da |
| Heavy Atoms | 50 |
| Complexity | 1370.0 |
| SMILES | CN1C2=C(C[C@]3([C@H]4CC5=C6[C@]3([C@H]2OC6=C(C=C5)O)CCN4CC7CC7)O)C8=C1[C@H]9[C@@]12CCN([C@@H]([C@@]1(C8)O)CC1=C2C(=C(C=C1)O)O9)CC1CC1 |
| InChIKey | DKIVQMBUHVYDFC-IWRYZOJTSA-N |
Chemical Property Profile of Binaltorphimine
Property Insights of Binaltorphimine
The XLogP value of 3.2 indicates that Binaltorphimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Binaltorphimine. Following Lipinski's Rule of Five, Binaltorphimine has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Binaltorphimine?
The CAS number of Binaltorphimine is 105618-27-7.
What is the molecular formula of Binaltorphimine?
The molecular formula of Binaltorphimine is C41H45N3O6.
What is the molecular weight of Binaltorphimine?
The molecular weight of Binaltorphimine is 675.3308 g/mol.
Where can I buy Binaltorphimine?
You can request a quote for Binaltorphimine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Binaltorphimine?
Yes, CoreyChem provides custom synthesis services for Binaltorphimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.