D364-0429 Screening compound: 3-(3-chlorophenyl)-5-{5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-3-yl}-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione

D364-0429 Screening compound: 3-(3-chlorophenyl)-5-{5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-3-yl}-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione
D364-0429 Screening compound: 3-(3-chlorophenyl)-5-{5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-3-yl}-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D364-0429
3-(3-chlorophenyl)-5-{5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-3-yl}-6-hydroxy-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

D364-0429

Molecular Formula

C21H20ClN5O3 (C21 H20 ClN5 O3)

Compound Name

3-(3-chlorophenyl)-5-{5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-3-yl}-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

3-(3-chlorophenyl)-5-{5-[4-(dimethylamino)phenyl]-45-dihydro-1H-pyrazol-3-yl}-6-hydroxy-1234-tetrahydropyrimidine-24-dione

SMILES

CN(C)c1ccc(C(C2)NN=C2C(C(N(c2cccc(Cl)c2)C(N2)=O)=O)=C2O)cc1

InChI

InChI=1S/C21H20ClN5O3/c1-26(2)14-8-6-12(7-9-14)16-11-17(25-24-16)18-19(28)23-21(30)27(20(18)29)15-5-3-4-13(22)10-15/h3-10,16,24,28H,11H2,1-2H3,(H,23,30)/t16-/m1/s1

InChI Key

QKXUDWLDALWUCY-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD27582062

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.730

Distribution Coefficient, logD

-2.899

Water Solubility, LogSw

-3.54

Polar Surface Area

83.165

Acid Dissociation Constant (pKa)

1.77

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with D364-0429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D364-0429?
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What is the minimum amount of D364-0429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D364-0429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D364-0429
  • 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 D364-0429 available by request