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achatin I structure
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achatin I

TL;DR: achatin I (CAS 121912-19-4) is a chemical compound with molecular formula C18H24N4O7 and molecular weight 408.1645 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[2-[[2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino]propanoylamino]butanedioic acid

Also Known As: achatin I, 2-[2-[[2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino]propanoylamino]butanedioic acid

CAS Number
121912-19-4
Molecular Formula
C18H24N4O7
Molecular Weight
408.1645 g/mol
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Technical Specifications

Molecular FormulaC18H24N4O7
Molecular Weight408.1645 g/mol
XLogP-3.5
Topological Polar Surface Area (TPSA)188.0 Ų
Hydrogen Bond Donors6
Hydrogen Bond Acceptors8
Rotatable Bonds11
Exact Mass408.1645 Da
Heavy Atoms29
Complexity619.0
SMILESCC(C(=O)NC(CC(=O)O)C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CN
InChIKeyZCPBEAHAVUJKAE-UHFFFAOYSA-N

Chemical Property Profile of achatin I

XLogP
-3.5
TPSA (Topological Polar Surface Area)
188.0
Hydrogen Bond Donors
6
Hydrogen Bond Acceptors
8
Rotatable Bonds
11
Heavy Atoms
29
Complexity
619.0
Exact Mass
408.1645
Monoisotopic Mass
408.1645
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 achatin I

The XLogP value of -3.5 indicates that achatin I is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 188.0 Ų indicates high polarity, suggesting achatin I may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, achatin I has 6 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 achatin I?

The CAS number of achatin I is 121912-19-4.

What is the molecular formula of achatin I?

The molecular formula of achatin I is C18H24N4O7.

What is the molecular weight of achatin I?

The molecular weight of achatin I is 408.1645 g/mol.

Where can I buy achatin I?

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

Does CoreyChem offer custom synthesis for achatin I?

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

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