C260-0759 Screening compound: 4-{1-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-fluorophenyl)methyl]butanamide

C260-0759 Screening compound: 4-{1-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-fluorophenyl)methyl]butanamide
C260-0759 Screening compound: 4-{1-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-fluorophenyl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-0759
4-{1-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-[(4-fluorophenyl)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

C260-0759

Molecular Formula

C26H23ClFN3O3 (C26 H23 ClFN3 O3)

Compound Name

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

IUPAC name

4-{1-[(2-chlorophenyl)methyl]-24-dioxo-1234-tetrahydroquinazolin-3-yl}-N-[(4-fluorophenyl)methyl]butanamide

SMILES

O=C(CCCN(C(c(cccc1)c1N1Cc(cccc2)c2Cl)=O)C1=O)NCc(cc1)ccc1F

InChI

InChI=1S/C26H23ClFN3O3/c27-22-8-3-1-6-19(22)17-31-23-9-4-2-7-21(23)25(33)30(26(31)34)15-5-10-24(32)29-16-18-11-13-20(28)14-12-18/h1-4,6-9,11-14H,5,10,15-17H2,(H,29,32)

InChI Key

YNZRCWFHOMVKLO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14737402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.94

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

3.772

Distribution Coefficient, logD

3.772

Water Solubility, LogSw

-4.21

Polar Surface Area

55.717

Acid Dissociation Constant (pKa)

12.59

Base Dissociation Constant (pKb)

-1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with C260-0759 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-0759?
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What is the minimum amount of C260-0759 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-0759
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-0759
  • 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 C260-0759 available by request