D364-0846 Screening compound: 5-[1-acetyl-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-benzyl-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione

D364-0846 Screening compound: 5-[1-acetyl-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-benzyl-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione
D364-0846 Screening compound: 5-[1-acetyl-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-benzyl-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D364-0846
5-[1-acetyl-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-benzyl-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

D364-0846

Molecular Formula

C25H26N4O7 (C25 H26 N4 O7)

Compound Name

5-[1-acetyl-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-benzyl-6-hydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

5-[1-acetyl-5-(345-trimethoxyphenyl)-45-dihydro-1H-pyrazol-3-yl]-3-benzyl-6-hydroxy-1234-tetrahydropyrimidine-24-dione

SMILES

CC(N(C(C1)c(cc2OC)cc(OC)c2OC)N=C1C(C(N(Cc1ccccc1)C(N1)=O)=O)=C1O)=O

InChI

InChI=1S/C25H26N4O7/c1-14(30)29-18(16-10-19(34-2)22(36-4)20(11-16)35-3)12-17(27-29)21-23(31)26-25(33)28(24(21)32)13-15-8-6-5-7-9-15/h5-11,18,31H,12-13H2,1-4H3,(H,26,33)/t18-/m1/s1

InChI Key

NZKYOEIGNTXFBG-GOSISDBHSA-N

MDL Number (MFCD)

MFCD27582182

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.5

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.236

Distribution Coefficient, logD

-3.177

Water Solubility, LogSw

-2.98

Polar Surface Area

107.244

Acid Dissociation Constant (pKa)

1.99

Base Dissociation Constant (pKb)

1.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with D364-0846 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D364-0846?
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What is the minimum amount of D364-0846 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D364-0846
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D364-0846
  • 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 D364-0846 available by request