Catalog No.:AA01EOTJ

155471-10-6 | (2-methyl-1-pentyl-1H-indol-3-yl)-1-naphthalenyl-methanone

Name: Name:(2-methyl-1-pentyl-1H-indol-3-yl)-1-naphthalenyl-methanone
Brand: AABLOCKS
SKU: AA01EOTJ
Rating: 90 (10 reviews)

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Technical Information
Properties
Literature
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Technical Information

Catalog Number:

AA01EOTJ

Chemical Name:

(2-methyl-1-pentyl-1H-indol-3-yl)-1-naphthalenyl-methanone

CAS Number:

155471-10-6

Molecular Formula:

C25H25NO

Molecular Weight:

355.4721

MDL Number:

MFCD19440815

SMILES:

CCCCCn1c(C)c(c2c1cccc2)C(=O)c1cccc2c1cccc2

Properties

Computed Properties

Complexity:

503

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Rotatable Bond Count:

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.7

Literature

Title: Three-dimensional quantitative structure-selectivity relationships analysis guided rational design of a highly selective ligand for the cannabinoid receptor 2.

Journal: European journal of medicinal chemistry 20110201

Title: Development of CoMFA and CoMSIA models of affinity and selectivity for indole ligands of cannabinoid CB1 and CB2 receptors.

Journal: European journal of medicinal chemistry 20090601

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Tags:155471-10-6 Molecular Formula|155471-10-6 MDL|155471-10-6 SMILES|155471-10-6 (2-methyl-1-pentyl-1H-indol-3-yl)-1-naphthalenyl-methanone

Catalog No.: AA01EOTJ

155471-10-6 | (2-methyl-1-pentyl-1H-indol-3-yl)-1-naphthalenyl-methanone

This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.

Inquire

Technical Information

Catalog Number: AA01EOTJ

Chemical Name: (2-methyl-1-pentyl-1H-indol-3-yl)-1-naphthalenyl-methanone

CAS Number: 155471-10-6

Molecular Formula: C25H25NO

Molecular Weight: 355.4721

MDL Number: MFCD19440815

SMILES: CCCCCn1c(C)c(c2c1cccc2)C(=O)c1cccc2c1cccc2

Properties

Complexity: 503

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 27

Hydrogen Bond Acceptor Count: 1

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 6

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 6.7

Literature fold

Title: Three-dimensional quantitative structure-selectivity relationships analysis guided rational design of a highly selective ligand for the cannabinoid receptor 2.

Journal: European journal of medicinal chemistry20110201

Title: Development of CoMFA and CoMSIA models of affinity and selectivity for indole ligands of cannabinoid CB1 and CB2 receptors.

Journal: European journal of medicinal chemistry20090601