V016-9109 Screening compound: ethyl 6-[(4-cyclopropanecarbonyl-3-methylpiperazin-1-yl)methyl]-1-ethyl-4-(2-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V016-9109 Screening compound: ethyl 6-[(4-cyclopropanecarbonyl-3-methylpiperazin-1-yl)methyl]-1-ethyl-4-(2-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V016-9109 Screening compound: ethyl 6-[(4-cyclopropanecarbonyl-3-methylpiperazin-1-yl)methyl]-1-ethyl-4-(2-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-9109
ethyl 6-[(4-cyclopropanecarbonyl-3-methylpiperazin-1-yl)methyl]-1-ethyl-4-(2-fluorophenyl)-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

V016-9109

Molecular Formula

C25H33FN4O4 (C25 H33 FN4 O4)

Compound Name

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

IUPAC name

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

SMILES

CCN(C(CN(CC1)CC(C)N1C(C1CC1)=O)=C(C(c(cccc1)c1F)N1)C(OCC)=O)C1=O

InChI

InChI=1S/C25H33FN4O4/c1-4-29-20(15-28-12-13-30(16(3)14-28)23(31)17-10-11-17)21(24(32)34-5-2)22(27-25(29)33)18-8-6-7-9-19(18)26/h6-9,16-17,22H,4-5,10-15H2,1-3H3,(H,27,33)

InChI Key

ABURYMSOCJSHBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19809475

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

472.56

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

2.891

Distribution Coefficient, logD

2.051

Water Solubility, LogSw

-3.13

Polar Surface Area

68.679

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

8.17

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

56.00

References: we are preparing a list of scientific research reports with V016-9109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-9109?
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What is the minimum amount of V016-9109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-9109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-9109
  • 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 V016-9109 available by request