D433-1187 Screening compound: N-(2-methoxyphenyl)-N-({5-methyl-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-2-phenylbutanamide

D433-1187 Screening compound: N-(2-methoxyphenyl)-N-({5-methyl-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-2-phenylbutanamide
D433-1187 Screening compound: N-(2-methoxyphenyl)-N-({5-methyl-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-2-phenylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D433-1187
N-(2-methoxyphenyl)-N-({5-methyl-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-2-phenylbutanamide

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

D433-1187

Molecular Formula

C24H25N5O3 (C24 H25 N5 O3)

Compound Name

N-(2-methoxyphenyl)-N-({5-methyl-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-2-phenylbutanamide

IUPAC name

N-(2-methoxyphenyl)-N-({5-methyl-7-oxo-4H7H-[124]triazolo[15-a]pyrimidin-2-yl}methyl)-2-phenylbutanamide

SMILES

CCC(C(N(Cc(nc1NC(C)=C2)nn1C2=O)c(cccc1)c1OC)=O)c1ccccc1

InChI

InChI=1S/C24H25N5O3/c1-4-18(17-10-6-5-7-11-17)23(31)28(19-12-8-9-13-20(19)32-3)15-21-26-24-25-16(2)14-22(30)29(24)27-21/h5-14,18H,4,15H2,1-3H3,(H,25,26,27)/t18-/m1/s1

InChI Key

PITGTRHTRPBNFR-GOSISDBHSA-N

MDL Number (MFCD)

MFCD27586054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.225

Distribution Coefficient, logD

0.573

Water Solubility, LogSw

-3.57

Polar Surface Area

74.676

Acid Dissociation Constant (pKa)

4.75

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

D433-1187 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D433-1187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D433-1187?
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What is the minimum amount of D433-1187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D433-1187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D433-1187
  • 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 D433-1187 available by request