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CTOP structure
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CTOP

TL;DR: CTOP (CAS 103429-31-8) is a chemical compound with molecular formula C50H67N11O11S2 and molecular weight 1061.4463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(1-amino-3-hydroxy-1-oxobutan-2-yl)-19-[(2-amino-3-phenylpropanoyl)amino]-10-(3-aminopropyl)-7-(1-hydroxyethyl)-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-3,3-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide

Also Known As: CTOP, CTOPA, Ctop-NH2, FCYWXTXT, CTOP TFA

CAS Number
103429-31-8
Molecular Formula
C50H67N11O11S2
Molecular Weight
1061.4463 g/mol
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Technical Specifications

Molecular FormulaC50H67N11O11S2
Molecular Weight1061.4463 g/mol
XLogP0.5
Topological Polar Surface Area (TPSA)426.0 Ų
Hydrogen Bond Donors14
Hydrogen Bond Acceptors15
Rotatable Bonds16
Exact Mass1061.4463 Da
Heavy Atoms74
Complexity1930.0
SMILESCC(C1C(=O)NC(C(SSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCN)CC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)O)NC(=O)C(CC5=CC=CC=C5)N)(C)C)C(=O)NC(C(C)O)C(=O)N)O
InChIKeyPZWWYAHWHHNCHO-UHFFFAOYSA-N

Chemical Property Profile of CTOP

XLogP
0.5
TPSA (Topological Polar Surface Area)
426.0
Hydrogen Bond Donors
14
Hydrogen Bond Acceptors
15
Rotatable Bonds
16
Heavy Atoms
74
Complexity
1930.0
Exact Mass
1061.4463
Monoisotopic Mass
1061.4463
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 CTOP

The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTOP. The TPSA of 426.0 Ų indicates high polarity, suggesting CTOP may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTOP has 14 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of CTOP?

The CAS number of CTOP is 103429-31-8.

What is the molecular formula of CTOP?

The molecular formula of CTOP is C50H67N11O11S2.

What is the molecular weight of CTOP?

The molecular weight of CTOP is 1061.4463 g/mol.

Where can I buy CTOP?

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

Does CoreyChem offer custom synthesis for CTOP?

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

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