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RefChem:219903 structure
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RefChem:219903

TL;DR: RefChem:219903 (CAS 116989-39-0) is a chemical compound with molecular formula C14H29ClN2O5 and molecular weight 340.1765 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one;hydrochloride

Also Known As: 1,4,7,10-Tetraoxa-13-azacyclopentadecane, 13-(4-amino-1-oxobutyl)-, monohydrochloride, 13-(4-Amino-1-oxobutyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane monohydrochloride, 4-amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-one hydrochloride, 4-Amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadecan-13-yl)butan-1-one--hydrogen chloride (1/1)

CAS Number
116989-39-0
Molecular Formula
C14H29ClN2O5
Molecular Weight
340.1765 g/mol
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Technical Specifications

Molecular FormulaC14H29ClN2O5
Molecular Weight340.1765 g/mol
XLogP0.0557
Topological Polar Surface Area (TPSA)83.3 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds3
Exact Mass340.1765 Da
Heavy Atoms22
Complexity250.0
SMILESC1COCCOCCOCCOCCN1C(=O)CCCN.Cl
InChIKeyRWTWMCJLMZQKPO-UHFFFAOYSA-N

Chemical Property Profile of RefChem:219903

XLogP
0.0557
TPSA (Topological Polar Surface Area)
83.3
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
3
Heavy Atoms
22
Complexity
250.0
Exact Mass
340.1765
Monoisotopic Mass
340.1765
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 RefChem:219903

The XLogP value of 0.0557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:219903. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:219903. Following Lipinski's Rule of Five, RefChem:219903 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:219903?

The CAS number of RefChem:219903 is 116989-39-0.

What is the molecular formula of RefChem:219903?

The molecular formula of RefChem:219903 is C14H29ClN2O5.

What is the molecular weight of RefChem:219903?

The molecular weight of RefChem:219903 is 340.1765 g/mol.

Where can I buy RefChem:219903?

You can request a quote for RefChem:219903 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:219903?

Yes, CoreyChem provides custom synthesis services for RefChem:219903 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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