V019-3776 Screening compound: ethyl 4-(3,4-dichlorophenyl)-1-ethyl-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V019-3776 Screening compound: ethyl 4-(3,4-dichlorophenyl)-1-ethyl-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V019-3776 Screening compound: ethyl 4-(3,4-dichlorophenyl)-1-ethyl-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-3776
ethyl 4-(3,4-dichlorophenyl)-1-ethyl-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-2-oxo-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

V019-3776

Molecular Formula

C27H29Cl2FN4O4 (C27 H29 Cl2 FN4 O4)

Compound Name

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

IUPAC name

ethyl 4-(34-dichlorophenyl)-1-ethyl-6-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCN(C(CN(CC1)CCN1C(c(cc1)ccc1F)=O)=C(C(c(cc1)cc(Cl)c1Cl)N1)C(OCC)=O)C1=O

InChI

InChI=1S/C27H29Cl2FN4O4/c1-3-34-22(16-32-11-13-33(14-12-32)25(35)17-5-8-19(30)9-6-17)23(26(36)38-4-2)24(31-27(34)37)18-7-10-20(28)21(29)15-18/h5-10,15,24H,3-4,11-14,16H2,1-2H3,(H,31,37)/t24-/m0/s1

InChI Key

IVSGHIZFTKTXLD-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19809431

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

563.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.393

Distribution Coefficient, logD

3.948

Water Solubility, LogSw

-4.65

Polar Surface Area

68.938

Acid Dissociation Constant (pKa)

9.24

Base Dissociation Constant (pKb)

7.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

References: we are preparing a list of scientific research reports with V019-3776 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-3776?
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What is the minimum amount of V019-3776 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-3776
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-3776
  • 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 V019-3776 available by request