8018-7963 Screening compound: 3-(4-benzamido-2-oxo-1,2-dihydropyrimidin-1-yl)-2-hydroxypropyl 3,4,5-trimethoxybenzoate

8018-7963 Screening compound: 3-(4-benzamido-2-oxo-1,2-dihydropyrimidin-1-yl)-2-hydroxypropyl 3,4,5-trimethoxybenzoate
8018-7963 Screening compound: 3-(4-benzamido-2-oxo-1,2-dihydropyrimidin-1-yl)-2-hydroxypropyl 3,4,5-trimethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7963
3-(4-benzamido-2-oxo-1,2-dihydropyrimidin-1-yl)-2-hydroxypropyl 3,4,5-trimethoxybenzoate

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

8018-7963

Molecular Formula

C24H25N3O8 (C24 H25 N3 O8)

Compound Name

3-(4-benzamido-2-oxo-1,2-dihydropyrimidin-1-yl)-2-hydroxypropyl 3,4,5-trimethoxybenzoate

IUPAC name

3-(4-benzamido-2-oxo-12-dihydropyrimidin-1-yl)-2-hydroxypropyl 345-trimethoxybenzoate

SMILES

COc1cc(C(OCC(CN(C=CC(NC(c2ccccc2)=O)=N2)C2=O)O)=O)cc(OC)c1OC

InChI

InChI=1S/C24H25N3O8/c1-32-18-11-16(12-19(33-2)21(18)34-3)23(30)35-14-17(28)13-27-10-9-20(26-24(27)31)25-22(29)15-7-5-4-6-8-15/h4-12,17,28H,13-14H2,1-3H3,(H,25,26,29,31)/t17-/m0/s1

InChI Key

ONNQWNVZQGUTKT-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD08532358

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.48

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.048

Distribution Coefficient, logD

1.791

Water Solubility, LogSw

-2.93

Polar Surface Area

109.784

Acid Dissociation Constant (pKa)

7.49

Base Dissociation Constant (pKb)

0.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

8018-7963 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 8018-7963 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7963?
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What is the minimum amount of 8018-7963 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7963
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7963
  • 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 8018-7963 available by request