8018-6573 Screening compound: 4-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]methoxy}-N,N-diethyl-3-methoxybenzamide

8018-6573 Screening compound: 4-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]methoxy}-N,N-diethyl-3-methoxybenzamide
8018-6573 Screening compound: 4-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]methoxy}-N,N-diethyl-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-6573
4-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]methoxy}-N,N-diethyl-3-methoxybenzamide

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

8018-6573

Molecular Formula

C27H26ClN3O4 (C27 H26 ClN3 O4)

Compound Name

4-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]methoxy}-N,N-diethyl-3-methoxybenzamide

IUPAC name

4-{[3-(4-chlorophenyl)-4-oxo-34-dihydroquinazolin-2-yl]methoxy}-NN-diethyl-3-methoxybenzamide

SMILES

CCN(CC)C(c(cc1)cc(OC)c1OCC(N1c(cc2)ccc2Cl)=Nc(cccc2)c2C1=O)=O

InChI

InChI=1S/C27H26ClN3O4/c1-4-30(5-2)26(32)18-10-15-23(24(16-18)34-3)35-17-25-29-22-9-7-6-8-21(22)27(33)31(25)20-13-11-19(28)12-14-20/h6-16H,4-5,17H2,1-3H3

InChI Key

RAYPWCDYLPSESK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08142218

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.97

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.061

Distribution Coefficient, logD

3.051

Water Solubility, LogSw

-3.59

Polar Surface Area

55.742

Acid Dissociation Constant (pKa)

21.13

Base Dissociation Constant (pKb)

5.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

8018-6573 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

PI3K-Targeted Library (17255 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-6573 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-6573?
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What is the minimum amount of 8018-6573 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-6573
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-6573
  • 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 8018-6573 available by request