C260-2229 Screening compound: N-[(2-chlorophenyl)methyl]-4-(1-{[(4-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)butanamide

C260-2229 Screening compound: N-[(2-chlorophenyl)methyl]-4-(1-{[(4-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)butanamide
C260-2229 Screening compound: N-[(2-chlorophenyl)methyl]-4-(1-{[(4-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-2229
N-[(2-chlorophenyl)methyl]-4-(1-{[(4-methoxyphenyl)carbamoyl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)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

C260-2229

Molecular Formula

C28H27ClN4O5 (C28 H27 ClN4 O5)

Compound Name

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

IUPAC name

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

SMILES

COc(cc1)ccc1NC(CN(c(cccc1)c1C(N1CCCC(NCc(cccc2)c2Cl)=O)=O)C1=O)=O

InChI

InChI=1S/C28H27ClN4O5/c1-38-21-14-12-20(13-15-21)31-26(35)18-33-24-10-5-3-8-22(24)27(36)32(28(33)37)16-6-11-25(34)30-17-19-7-2-4-9-23(19)29/h2-5,7-10,12-15H,6,11,16-18H2,1H3,(H,30,34)(H,31,35)

InChI Key

NSIOTQIPPGORRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14738476

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

535

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.429

Distribution Coefficient, logD

3.429

Water Solubility, LogSw

-3.85

Polar Surface Area

86.410

Acid Dissociation Constant (pKa)

12.52

Base Dissociation Constant (pKb)

4.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with C260-2229 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-2229?
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What is the minimum amount of C260-2229 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-2229
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-2229
  • 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 C260-2229 available by request