V020-0952 Screening compound: ethyl 1-ethyl-6-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V020-0952 Screening compound: ethyl 1-ethyl-6-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V020-0952 Screening compound: ethyl 1-ethyl-6-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-0952
ethyl 1-ethyl-6-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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

V020-0952

Molecular Formula

C34H38N4O6 (C34 H38 N4 O6)

Compound Name

ethyl 1-ethyl-6-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 1-ethyl-6-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-2-oxo-4-(3-phenoxyphenyl)-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCN(C(CN(CC1)CCN1C(c1cc(OC)ccc1)=O)=C(C(c1cc(Oc2ccccc2)ccc1)N1)C(OCC)=O)C1=O

InChI

InChI=1S/C34H38N4O6/c1-4-38-29(23-36-17-19-37(20-18-36)32(39)25-12-10-15-27(22-25)42-3)30(33(40)43-5-2)31(35-34(38)41)24-11-9-16-28(21-24)44-26-13-7-6-8-14-26/h6-16,21-22,31H,4-5,17-20,23H2,1-3H3,(H,35,41)/t31-/m1/s1

InChI Key

RSXIDSOYQFKUCV-WJOKGBTCSA-N

MDL Number (MFCD)

MFCD19809225

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

598.7

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.518

Distribution Coefficient, logD

4.072

Water Solubility, LogSw

-4.29

Polar Surface Area

83.229

Acid Dissociation Constant (pKa)

10.16

Base Dissociation Constant (pKb)

7.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.40

References: we are preparing a list of scientific research reports with V020-0952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-0952?
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What is the minimum amount of V020-0952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-0952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-0952
  • 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 V020-0952 available by request