D266-0571 Screening compound: N-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-2-ethyl-3-oxo-5,6-diphenyl-2,3-dihydropyridazine-4-carboxamide

D266-0571 Screening compound: N-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-2-ethyl-3-oxo-5,6-diphenyl-2,3-dihydropyridazine-4-carboxamide
D266-0571 Screening compound: N-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-2-ethyl-3-oxo-5,6-diphenyl-2,3-dihydropyridazine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D266-0571
N-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-2-ethyl-3-oxo-5,6-diphenyl-2,3-dihydropyridazine-4-carboxamide

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

D266-0571

Molecular Formula

C26H25N5O3S (C26 H25 N5 O3 S)

Compound Name

N-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-2-ethyl-3-oxo-5,6-diphenyl-2,3-dihydropyridazine-4-carboxamide

IUPAC name

N-[5-(dimethylcarbamoyl)-4-methyl-13-thiazol-2-yl]-2-ethyl-3-oxo-56-diphenyl-23-dihydropyridazine-4-carboxamide

SMILES

CCN1N=C(c2ccccc2)C(c2ccccc2)=C(C(Nc2nc(C)c(C(N(C)C)=O)s2)=O)C1=O

InChI

InChI=1S/C26H25N5O3S/c1-5-31-24(33)20(23(32)28-26-27-16(2)22(35-26)25(34)30(3)4)19(17-12-8-6-9-13-17)21(29-31)18-14-10-7-11-15-18/h6-15H,5H2,1-4H3,(H,27,28,32)

InChI Key

MDSQVIPXYPJPKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09057913

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.362

Distribution Coefficient, logD

2.459

Water Solubility, LogSw

-3.61

Polar Surface Area

76.907

Acid Dissociation Constant (pKa)

6.56

Base Dissociation Constant (pKb)

3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

D266-0571 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

References: we are preparing a list of scientific research reports with D266-0571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D266-0571?
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What is the minimum amount of D266-0571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D266-0571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D266-0571
  • 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 D266-0571 available by request