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RefChem:321641 structure
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RefChem:321641

TL;DR: RefChem:321641 (CAS 112885-12-8) is a chemical compound with molecular formula C20H19ClF5N3O3 and molecular weight 479.10352 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-amino-5-chloro-2-methoxy-N-[[4-[(2,3,4,5,6-pentafluorophenyl)methyl]morpholin-2-yl]methyl]benzamide

Also Known As: 4-Amino-5-chloro-2-methoxy-N-((4-((pentafluorophenyl)methyl)-2-morpholinyl)methyl)benzamide, Benzamide, 4-amino-5-chloro-2-methoxy-N-((4-((pentafluorophenyl)methyl)-2-morpholinyl)methyl)-, 4-amino-5-chloro-2-methoxy-N-({4-[(2,3,4,5,6-pentafluorophenyl)methyl]morpholin-2-yl}methyl)benzamide, 4-Amino-5-chloro-2-methoxy-N-({4-[(pentafluorophenyl)methyl]morpholin-2-yl}methyl)benzene-1-carboximidic acid, 4-Amino-5-chloro-2-methoxy-N-[[4-(2,3,4,5,6-pentafluorobenzyl)-2-morpholinyl]methyl]benzamide

CAS Number
112885-12-8
Molecular Formula
C20H19ClF5N3O3
Molecular Weight
479.10352 g/mol
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Technical Specifications

Molecular FormulaC20H19ClF5N3O3
Molecular Weight479.10352 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)76.8 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors10
Rotatable Bonds6
Exact Mass479.10352 Da
Heavy Atoms32
Complexity625.0
SMILESCOC1=CC(=C(C=C1C(=O)NCC2CN(CCO2)CC3=C(C(=C(C(=C3F)F)F)F)F)Cl)N
InChIKeyVPQZUMGQKZSAJM-UHFFFAOYSA-N

Chemical Property Profile of RefChem:321641

XLogP
2.8
TPSA (Topological Polar Surface Area)
76.8
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
10
Rotatable Bonds
6
Heavy Atoms
32
Complexity
625.0
Exact Mass
479.10352
Monoisotopic Mass
479.10352
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:321641

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:321641. The TPSA of 76.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:321641. Following Lipinski's Rule of Five, RefChem:321641 has 2 hydrogen bond donor(s) and 10 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:321641?

The CAS number of RefChem:321641 is 112885-12-8.

What is the molecular formula of RefChem:321641?

The molecular formula of RefChem:321641 is C20H19ClF5N3O3.

What is the molecular weight of RefChem:321641?

The molecular weight of RefChem:321641 is 479.10352 g/mol.

Where can I buy RefChem:321641?

You can request a quote for RefChem:321641 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:321641?

Yes, CoreyChem provides custom synthesis services for RefChem:321641 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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