6434-3582 Screening compound: N-cyclohexyl-4-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)benzamide

6434-3582 Screening compound: N-cyclohexyl-4-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)benzamide
6434-3582 Screening compound: N-cyclohexyl-4-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6434-3582
N-cyclohexyl-4-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)benzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6434-3582

Molecular Formula

C22H23N3O2 (C22 H23 N3 O2)

Compound Name

N-cyclohexyl-4-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)benzamide

IUPAC name

N-cyclohexyl-4-(3-methyl-4-oxo-34-dihydrophthalazin-1-yl)benzamide

SMILES

CN1N=C(c(cc2)ccc2C(NC2CCCCC2)=O)c(cccc2)c2C1=O

InChI

InChI=1S/C22H23N3O2/c1-25-22(27)19-10-6-5-9-18(19)20(24-25)15-11-13-16(14-12-15)21(26)23-17-7-3-2-4-8-17/h5-6,9-14,17H,2-4,7-8H2,1H3,(H,23,26)

InChI Key

WCCJJZDAXPDVHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04155585

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.286

Distribution Coefficient, logD

3.286

Water Solubility, LogSw

-3.77

Polar Surface Area

51.285

Acid Dissociation Constant (pKa)

14.04

Base Dissociation Constant (pKb)

3.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

6434-3582 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Cardiovascular Library (22201 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Immune system
  • Cardiovascular

References: we are preparing a list of scientific research reports with 6434-3582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6434-3582?
Check Price and Availability of 6434-3582, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6434-3582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6434-3582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6434-3582
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6434-3582 available by request