V018-9040 Screening compound: ethyl 6-[(2,3-dimethylphenoxy)methyl]-4-(2-fluorophenyl)-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V018-9040 Screening compound: ethyl 6-[(2,3-dimethylphenoxy)methyl]-4-(2-fluorophenyl)-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V018-9040 Screening compound: ethyl 6-[(2,3-dimethylphenoxy)methyl]-4-(2-fluorophenyl)-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-9040
ethyl 6-[(2,3-dimethylphenoxy)methyl]-4-(2-fluorophenyl)-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

V018-9040

Molecular Formula

C23H25FN2O4 (C23 H25 FN2 O4)

Compound Name

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

IUPAC name

ethyl 6-[(23-dimethylphenoxy)methyl]-4-(2-fluorophenyl)-1-methyl-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c(cccc1)c1F)N1)=C(COc2c(C)c(C)ccc2)N(C)C1=O)=O

InChI

InChI=1S/C23H25FN2O4/c1-5-29-22(27)20-18(13-30-19-12-8-9-14(2)15(19)3)26(4)23(28)25-21(20)16-10-6-7-11-17(16)24/h6-12,21H,5,13H2,1-4H3,(H,25,28)/t21-/m0/s1

InChI Key

XUZGDRYGYVRNBN-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19832622

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.449

Distribution Coefficient, logD

4.443

Water Solubility, LogSw

-4.39

Polar Surface Area

56.104

Acid Dissociation Constant (pKa)

9.30

Base Dissociation Constant (pKb)

-5.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with V018-9040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-9040?
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What is the minimum amount of V018-9040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-9040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-9040
  • 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 V018-9040 available by request