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Bme-dtta structure
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Bme-dtta

TL;DR: Bme-dtta (CAS 141433-28-5) is a chemical compound with molecular formula C46H82N4O14 and molecular weight 914.58276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[[2-[2-[[2-[bis(carboxymethyl)amino]-2-oxoethyl]-(2-tetradecanoyloxyethyl)amino]ethyl-(2-tetradecanoyloxyethyl)amino]acetyl]-(carboxymethyl)amino]acetic acid

Also Known As: Bme-dtta, Gd-Bme-dtta, J1.158.827A, 2-[[2-[2-[[2-[bis(carboxymethyl)amino]-2-oxoethyl]-(2-tetradecanoyloxyethyl)amino]ethyl-(2-tetradecanoyloxyethyl)amino]acetyl]-(carboxymethyl)amino]acetic acid, N(3),N(6)-Bis(2'-myristoyloxyethyl)-1,8-dioxotriethylenetetramine-N,N,N',N'-tetraacetic acid

CAS Number
141433-28-5
Molecular Formula
C46H82N4O14
Molecular Weight
914.58276 g/mol
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Technical Specifications

Molecular FormulaC46H82N4O14
Molecular Weight914.58276 g/mol
XLogP5.4
Topological Polar Surface Area (TPSA)249.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors16
Rotatable Bonds47
Exact Mass914.58276 Da
Heavy Atoms64
Complexity1200.0
SMILESCCCCCCCCCCCCCC(=O)OCCN(CCN(CCOC(=O)CCCCCCCCCCCCC)CC(=O)N(CC(=O)O)CC(=O)O)CC(=O)N(CC(=O)O)CC(=O)O
InChIKeyDPPOUICPKFINOH-UHFFFAOYSA-N

Chemical Property Profile of Bme-dtta

XLogP
5.4
TPSA (Topological Polar Surface Area)
249.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
16
Rotatable Bonds
47
Heavy Atoms
64
Complexity
1200.0
Exact Mass
914.58276
Monoisotopic Mass
914.58276
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 Bme-dtta

The XLogP value of 5.4 indicates that Bme-dtta is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 249.0 Ų indicates high polarity, suggesting Bme-dtta may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bme-dtta has 4 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Bme-dtta?

The CAS number of Bme-dtta is 141433-28-5.

What is the molecular formula of Bme-dtta?

The molecular formula of Bme-dtta is C46H82N4O14.

What is the molecular weight of Bme-dtta?

The molecular weight of Bme-dtta is 914.58276 g/mol.

Where can I buy Bme-dtta?

You can request a quote for Bme-dtta directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Bme-dtta?

Yes, CoreyChem provides custom synthesis services for Bme-dtta and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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