P491-2793 Screening compound: N-ethyl-1-{[(3-fluoro-4-methylphenyl)carbamoyl]methyl}-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide

P491-2793 Screening compound: N-ethyl-1-{[(3-fluoro-4-methylphenyl)carbamoyl]methyl}-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide
P491-2793 Screening compound: N-ethyl-1-{[(3-fluoro-4-methylphenyl)carbamoyl]methyl}-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P491-2793
N-ethyl-1-{[(3-fluoro-4-methylphenyl)carbamoyl]methyl}-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide

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

P491-2793

Molecular Formula

C22H21FN4O3 (C22 H21 FN4 O3)

Compound Name

N-ethyl-1-{[(3-fluoro-4-methylphenyl)carbamoyl]methyl}-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxamide

IUPAC name

N-ethyl-1-{[(3-fluoro-4-methylphenyl)carbamoyl]methyl}-6-oxo-2-phenyl-16-dihydropyrimidine-5-carboxamide

SMILES

CCNC(C1=CN=C(c2ccccc2)N(CC(Nc2cc(F)c(C)cc2)=O)C1=O)=O

InChI

InChI=1S/C22H21FN4O3/c1-3-24-21(29)17-12-25-20(15-7-5-4-6-8-15)27(22(17)30)13-19(28)26-16-10-9-14(2)18(23)11-16/h4-12H,3,13H2,1-2H3,(H,24,29)(H,26,28)

InChI Key

YVSFNJFLIFQPSK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27575851

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.407

Distribution Coefficient, logD

2.406

Water Solubility, LogSw

-2.91

Polar Surface Area

72.799

Acid Dissociation Constant (pKa)

9.81

Base Dissociation Constant (pKb)

0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with P491-2793 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P491-2793?
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What is the minimum amount of P491-2793 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P491-2793
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P491-2793
  • 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 P491-2793 available by request