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AB00668461-01 structure
Fine Chemical

AB00668461-01

TL;DR: AB00668461-01 (CAS 1007195-31-4) is a chemical compound with molecular formula C23H19N3O2S and molecular weight 401.1198 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-naphthalen-1-yl-N-(5-oxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)acetamide

Also Known As: AB00668461-01, F0561-0776, 2-(naphthalen-1-yl)-N-{5-oxo-2-phenyl-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl}acetamide, 2-naphthalen-1-yl-N-(5-oxo-2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)acetamide, 2-(naphthalen-1-yl)-N-(5-oxido-2-phenyl-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)acetamide

CAS Number
1007195-31-4
Molecular Formula
C23H19N3O2S
Molecular Weight
401.1198 g/mol
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Technical Specifications

Molecular FormulaC23H19N3O2S
Molecular Weight401.1198 g/mol
XLogP3.0
Topological Polar Surface Area (TPSA)83.2 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass401.1198 Da
Heavy Atoms29
Complexity623.0
SMILESC1C2=C(N(N=C2CS1=O)C3=CC=CC=C3)NC(=O)CC4=CC=CC5=CC=CC=C54
InChIKeyYIINPEQYQXDCBF-UHFFFAOYSA-N

Chemical Property Profile of AB00668461-01

XLogP
3.0
TPSA (Topological Polar Surface Area)
83.2
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
29
Complexity
623.0
Exact Mass
401.1198
Monoisotopic Mass
401.1198
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 AB00668461-01

The XLogP value of 3.0 indicates that AB00668461-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668461-01. Following Lipinski's Rule of Five, AB00668461-01 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of AB00668461-01?

The CAS number of AB00668461-01 is 1007195-31-4.

What is the molecular formula of AB00668461-01?

The molecular formula of AB00668461-01 is C23H19N3O2S.

What is the molecular weight of AB00668461-01?

The molecular weight of AB00668461-01 is 401.1198 g/mol.

Where can I buy AB00668461-01?

You can request a quote for AB00668461-01 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for AB00668461-01?

Yes, CoreyChem provides custom synthesis services for AB00668461-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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