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Binaltorphimine structure
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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))-

CAS Number
105618-27-7
Molecular Formula
C41H45N3O6
Molecular Weight
675.3308 g/mol
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Technical Specifications

Molecular FormulaC41H45N3O6
Molecular Weight675.3308 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)111.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors8
Rotatable Bonds4
Exact Mass675.3308 Da
Heavy Atoms50
Complexity1370.0
SMILESCN1C2=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
InChIKeyDKIVQMBUHVYDFC-IWRYZOJTSA-N

Product Description

Applications: Binaltorphimine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Binaltorphimine (CAS 105618-27-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Binaltorphimine is a fine chemical identified by CAS number 105618-27-7 and the molecular formula C41H45N3O6 and a molecular weight of 675.33 g/mol. It is also known as Binaltorphimine and Bni ligand.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Binaltorphimine

XLogP
3.2
TPSA (Topological Polar Surface Area)
111.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
8
Rotatable Bonds
4
Heavy Atoms
50
Complexity
1370.0
Exact Mass
675.3308
Monoisotopic Mass
675.3308
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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.

What are the applications of Binaltorphimine?

Binaltorphimine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Binaltorphimine (CAS 105618-27-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...

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.

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