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Napsamycin C structure
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Napsamycin C

TL;DR: Napsamycin C (CAS 144379-26-0) is a chemical compound with molecular formula C39H50N8O12S and molecular weight 854.3269 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[[1-[[1-[[5-(2,4-dioxo-1,3-diazinan-1-yl)-4-hydroxyoxolan-2-ylidene]methylamino]-3-[(6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carbonyl)-methylamino]-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamoylamino]-3-(3-hydroxyphenyl)propanoic acid

Also Known As: Napsamycin C

CAS Number
144379-26-0
Molecular Formula
C39H50N8O12S
Molecular Weight
854.3269 g/mol
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Technical Specifications

Molecular FormulaC39H50N8O12S
Molecular Weight854.3269 g/mol
XLogP-2.7
Topological Polar Surface Area (TPSA)314.0 Ų
Hydrogen Bond Donors10
Hydrogen Bond Acceptors14
Rotatable Bonds16
Exact Mass854.3269 Da
Heavy Atoms60
Complexity1620.0
SMILESCC(C(C(=O)NC=C1CC(C(O1)N2CCC(=O)NC2=O)O)NC(=O)C(CCSC)NC(=O)NC(CC3=CC(=CC=C3)O)C(=O)O)N(C)C(=O)C4CC5=C(CN4)C=CC(=C5)O
InChIKeyMFEPAAMYDYMBSN-UHFFFAOYSA-N

Chemical Property Profile of Napsamycin C

XLogP
-2.7
TPSA (Topological Polar Surface Area)
314.0
Hydrogen Bond Donors
10
Hydrogen Bond Acceptors
14
Rotatable Bonds
16
Heavy Atoms
60
Complexity
1620.0
Exact Mass
854.3269
Monoisotopic Mass
854.3269
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 Napsamycin C

The XLogP value of -2.7 indicates that Napsamycin C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 314.0 Ų indicates high polarity, suggesting Napsamycin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Napsamycin C has 10 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Napsamycin C?

The CAS number of Napsamycin C is 144379-26-0.

What is the molecular formula of Napsamycin C?

The molecular formula of Napsamycin C is C39H50N8O12S.

What is the molecular weight of Napsamycin C?

The molecular weight of Napsamycin C is 854.3269 g/mol.

Where can I buy Napsamycin C?

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

Does CoreyChem offer custom synthesis for Napsamycin C?

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

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