D364-0911 Screening compound: 5-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(4-chlorophenyl)-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione

D364-0911 Screening compound: 5-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(4-chlorophenyl)-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione
D364-0911 Screening compound: 5-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(4-chlorophenyl)-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D364-0911
5-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-3-(4-chlorophenyl)-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

D364-0911

Molecular Formula

C21H17ClN4O4 (C21 H17 ClN4 O4)

Compound Name

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

IUPAC name

5-(1-acetyl-5-phenyl-45-dihydro-1H-pyrazol-3-yl)-3-(4-chlorophenyl)-6-hydroxy-1234-tetrahydropyrimidine-24-dione

SMILES

CC(N(C(C1)c2ccccc2)N=C1C(C(N(c(cc1)ccc1Cl)C(N1)=O)=O)=C1O)=O

InChI

InChI=1S/C21H17ClN4O4/c1-12(27)26-17(13-5-3-2-4-6-13)11-16(24-26)18-19(28)23-21(30)25(20(18)29)15-9-7-14(22)8-10-15/h2-10,17,28H,11H2,1H3,(H,23,30)/t17-/m1/s1

InChI Key

ZGXOYPQHYZNSGT-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD27582200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.84

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.491

Distribution Coefficient, logD

-2.941

Water Solubility, LogSw

-3.09

Polar Surface Area

83.655

Acid Dissociation Constant (pKa)

1.97

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with D364-0911 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D364-0911?
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What is the minimum amount of D364-0911 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D364-0911
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D364-0911
  • 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 D364-0911 available by request