D364-1314 Screening compound: 3-butyl-6-hydroxy-5-[5-(2-methoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

D364-1314 Screening compound: 3-butyl-6-hydroxy-5-[5-(2-methoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
D364-1314 Screening compound: 3-butyl-6-hydroxy-5-[5-(2-methoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D364-1314
3-butyl-6-hydroxy-5-[5-(2-methoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-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

D364-1314

Molecular Formula

C21H26N4O5 (C21 H26 N4 O5)

Compound Name

3-butyl-6-hydroxy-5-[5-(2-methoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

3-butyl-6-hydroxy-5-[5-(2-methoxyphenyl)-1-propanoyl-45-dihydro-1H-pyrazol-3-yl]-1234-tetrahydropyrimidine-24-dione

SMILES

CCCCN(C(C(C(CC1c(cccc2)c2OC)=NN1C(CC)=O)=C(N1)O)=O)C1=O

InChI

InChI=1S/C21H26N4O5/c1-4-6-11-24-20(28)18(19(27)22-21(24)29)14-12-15(25(23-14)17(26)5-2)13-9-7-8-10-16(13)30-3/h7-10,15,27H,4-6,11-12H2,1-3H3,(H,22,29)/t15-/m1/s1

InChI Key

WASZZJUVTCZGQK-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD27582298

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.875

Distribution Coefficient, logD

-2.190

Water Solubility, LogSw

-3.27

Polar Surface Area

91.152

Acid Dissociation Constant (pKa)

2.33

Base Dissociation Constant (pKb)

-1.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with D364-1314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D364-1314?
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What is the minimum amount of D364-1314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D364-1314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D364-1314
  • 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 D364-1314 available by request