D364-0036 Screening compound: 6-hydroxy-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

D364-0036 Screening compound: 6-hydroxy-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
D364-0036 Screening compound: 6-hydroxy-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D364-0036
6-hydroxy-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

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

D364-0036

Molecular Formula

C16H16N4O3 (C16 H16 N4 O3)

Compound Name

6-hydroxy-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

6-hydroxy-5-(5-phenyl-45-dihydro-1H-pyrazol-3-yl)-3-(prop-2-en-1-yl)-1234-tetrahydropyrimidine-24-dione

SMILES

C=CCN(C(C(C(C1)=NNC1c1ccccc1)=C(N1)O)=O)C1=O

InChI

InChI=1S/C16H16N4O3/c1-2-8-20-15(22)13(14(21)17-16(20)23)12-9-11(18-19-12)10-6-4-3-5-7-10/h2-7,11,18,21H,1,8-9H2,(H,17,23)/t11-/m1/s1

InChI Key

UNOYCHUWZQHCNG-LLVKDONJSA-N

MDL Number (MFCD)

MFCD27581915

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.481

Distribution Coefficient, logD

-3.494

Water Solubility, LogSw

-1.89

Polar Surface Area

81.222

Acid Dissociation Constant (pKa)

2.42

Base Dissociation Constant (pKb)

1.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.80

D364-0036 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D364-0036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D364-0036?
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What is the minimum amount of D364-0036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D364-0036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D364-0036
  • 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 D364-0036 available by request