C260-1068 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide

C260-1068 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide
C260-1068 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1068
N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide

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

C260-1068

Molecular Formula

C28H27Cl2N3O3 (C28 H27 Cl2 N3 O3)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}pentanamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-5-{1-[(4-chlorophenyl)methyl]-24-dioxo-1234-tetrahydroquinazolin-3-yl}pentanamide

SMILES

O=C(CCCCN(C(c(cccc1)c1N1Cc(cc2)ccc2Cl)=O)C1=O)NCCc(cc1)ccc1Cl

InChI

InChI=1S/C28H27Cl2N3O3/c29-22-12-8-20(9-13-22)16-17-31-26(34)7-3-4-18-32-27(35)24-5-1-2-6-25(24)33(28(32)36)19-21-10-14-23(30)15-11-21/h1-2,5-6,8-15H,3-4,7,16-19H2,(H,31,34)

InChI Key

BPHQPVDJPFYIIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14737553

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.737

Distribution Coefficient, logD

4.737

Water Solubility, LogSw

-4.94

Polar Surface Area

55.558

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

3.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with C260-1068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-1068?
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What is the minimum amount of C260-1068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1068
  • 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 C260-1068 available by request