C260-1072 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-[1-({[(furan-2-yl)methyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]pentanamide

C260-1072 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-[1-({[(furan-2-yl)methyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]pentanamide
C260-1072 Screening compound: N-[2-(4-chlorophenyl)ethyl]-5-[1-({[(furan-2-yl)methyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1072
N-[2-(4-chlorophenyl)ethyl]-5-[1-({[(furan-2-yl)methyl]carbamoyl}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

C260-1072

Molecular Formula

C28H29ClN4O5 (C28 H29 ClN4 O5)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCCCN(C(c(cccc1)c1N1CC(NCc2ccco2)=O)=O)C1=O)NCCc(cc1)ccc1Cl

InChI

InChI=1S/C28H29ClN4O5/c29-21-12-10-20(11-13-21)14-15-30-25(34)9-3-4-16-32-27(36)23-7-1-2-8-24(23)33(28(32)37)19-26(35)31-18-22-6-5-17-38-22/h1-2,5-8,10-13,17H,3-4,9,14-16,18-19H2,(H,30,34)(H,31,35)

InChI Key

BBLFCWYBMFTVFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14737557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.01

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.876

Distribution Coefficient, logD

2.876

Water Solubility, LogSw

-3.89

Polar Surface Area

87.778

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

3.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with C260-1072 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of C260-1072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1072
  • 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 C260-1072 available by request