V020-1616 Screening compound: ethyl 4-(3-fluorophenyl)-6-{[4-(4-methoxybenzoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V020-1616 Screening compound: ethyl 4-(3-fluorophenyl)-6-{[4-(4-methoxybenzoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V020-1616 Screening compound: ethyl 4-(3-fluorophenyl)-6-{[4-(4-methoxybenzoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-1616
ethyl 4-(3-fluorophenyl)-6-{[4-(4-methoxybenzoyl)-3-methylpiperazin-1-yl]methyl}-1-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

V020-1616

Molecular Formula

C28H33FN4O5 (C28 H33 FN4 O5)

Compound Name

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

IUPAC name

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

SMILES

CCOC(C(C(c1cccc(F)c1)N1)=C(CN(CC2)CC(C)N2C(c(cc2)ccc2OC)=O)N(C)C1=O)=O

InChI

InChI=1S/C28H33FN4O5/c1-5-38-27(35)24-23(31(3)28(36)30-25(24)20-7-6-8-21(29)15-20)17-32-13-14-33(18(2)16-32)26(34)19-9-11-22(37-4)12-10-19/h6-12,15,18,25H,5,13-14,16-17H2,1-4H3,(H,30,36)

InChI Key

MGNFPMYNJJQFSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19812639

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

524.59

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.032

Distribution Coefficient, logD

2.518

Water Solubility, LogSw

-3.31

Polar Surface Area

75.741

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

7.76

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.30

References: we are preparing a list of scientific research reports with V020-1616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1616?
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What is the minimum amount of V020-1616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1616
  • 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 V020-1616 available by request