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3-(phenylmethyl)-1h-indazole structure
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3-(phenylmethyl)-1h-indazole

TL;DR: 3-(phenylmethyl)-1h-indazole (CAS 152537-71-8) is a chemical compound with molecular formula C12H19N5O3S and molecular weight 313.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxymethyl]butane-1-sulfonamide

Also Known As: 3-(phenylmethyl)-1h-indazole, 6-(2-Ethyl-2-methyl-3-sulfamoyl-1-propoxy)-7-methyl(1,2,4)triazolo(1,5-b)pyridazine, 1-Butanesulfonamide, 2-methyl-2-(((7-methyl(1,2,4)triazolo(1,5-b)pyridazin-6-yl)oxy)methyl)-, 2-Methyl-2-(((7-methyl(1,2,4)triazolo(1,5-b)pyridazin-6-yl)oxy)methyl)-1-butanesulfonamide, 2-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxymethyl]butane-1-sulfonamide

CAS Number
152537-71-8
Molecular Formula
C12H19N5O3S
Molecular Weight
313.12085 g/mol
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Technical Specifications

Molecular FormulaC12H19N5O3S
Molecular Weight313.12085 g/mol
XLogP1.2
Topological Polar Surface Area (TPSA)121.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds6
Exact Mass313.12085 Da
Heavy Atoms21
Complexity454.0
SMILESCCC(C)(COC1=NN2C(=NC=N2)C=C1C)CS(=O)(=O)N
InChIKeyIJFQVZAPJZHQTN-UHFFFAOYSA-N

Chemical Property Profile of 3-(phenylmethyl)-1h-indazole

XLogP
1.2
TPSA (Topological Polar Surface Area)
121.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
6
Heavy Atoms
21
Complexity
454.0
Exact Mass
313.12085
Monoisotopic Mass
313.12085
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 3-(phenylmethyl)-1h-indazole

The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(phenylmethyl)-1h-indazole. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(phenylmethyl)-1h-indazole. Following Lipinski's Rule of Five, 3-(phenylmethyl)-1h-indazole has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-(phenylmethyl)-1h-indazole?

The CAS number of 3-(phenylmethyl)-1h-indazole is 152537-71-8.

What is the molecular formula of 3-(phenylmethyl)-1h-indazole?

The molecular formula of 3-(phenylmethyl)-1h-indazole is C12H19N5O3S.

What is the molecular weight of 3-(phenylmethyl)-1h-indazole?

The molecular weight of 3-(phenylmethyl)-1h-indazole is 313.12085 g/mol.

Where can I buy 3-(phenylmethyl)-1h-indazole?

You can request a quote for 3-(phenylmethyl)-1h-indazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-(phenylmethyl)-1h-indazole?

Yes, CoreyChem provides custom synthesis services for 3-(phenylmethyl)-1h-indazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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