C260-2692 Screening compound: 4-{1-[(3-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-methylphenyl)methyl]butanamide

C260-2692 Screening compound: 4-{1-[(3-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-methylphenyl)methyl]butanamide
C260-2692 Screening compound: 4-{1-[(3-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-methylphenyl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-2692
4-{1-[(3-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-methylphenyl)methyl]butanamide

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

C260-2692

Molecular Formula

C27H26FN3O3 (C27 H26 FN3 O3)

Compound Name

4-{1-[(3-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-methylphenyl)methyl]butanamide

IUPAC name

4-{1-[(3-fluorophenyl)methyl]-24-dioxo-1234-tetrahydroquinazolin-3-yl}-N-[(4-methylphenyl)methyl]butanamide

SMILES

Cc1ccc(CNC(CCCN(C(c(cccc2)c2N2Cc3cccc(F)c3)=O)C2=O)=O)cc1

InChI

InChI=1S/C27H26FN3O3/c1-19-11-13-20(14-12-19)17-29-25(32)10-5-15-30-26(33)23-8-2-3-9-24(23)31(27(30)34)18-21-6-4-7-22(28)16-21/h2-4,6-9,11-14,16H,5,10,15,17-18H2,1H3,(H,29,32)

InChI Key

DFAVLLCHGHUQEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738816

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.804

Distribution Coefficient, logD

3.804

Water Solubility, LogSw

-3.90

Polar Surface Area

55.717

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

-0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with C260-2692 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-2692?
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What is the minimum amount of C260-2692 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-2692
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-2692
  • 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 C260-2692 available by request