L486-0592 Screening compound: 4-(7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(3-methylphenyl)piperidine-1-carboxamide

L486-0592 Screening compound: 4-(7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(3-methylphenyl)piperidine-1-carboxamide
L486-0592 Screening compound: 4-(7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(3-methylphenyl)piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L486-0592
4-(7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(3-methylphenyl)piperidine-1-carboxamide

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

L486-0592

Molecular Formula

C21H21ClN4O2 (C21 H21 ClN4 O2)

Compound Name

4-(7-chloro-4-oxo-3,4-dihydroquinazolin-3-yl)-N-(3-methylphenyl)piperidine-1-carboxamide

IUPAC name

4-(7-chloro-4-oxo-34-dihydroquinazolin-3-yl)-N-(3-methylphenyl)piperidine-1-carboxamide

SMILES

Cc1cccc(NC(N(CC2)CCC2N(C=Nc2c3ccc(Cl)c2)C3=O)=O)c1

InChI

InChI=1S/C21H21ClN4O2/c1-14-3-2-4-16(11-14)24-21(28)25-9-7-17(8-10-25)26-13-23-19-12-15(22)5-6-18(19)20(26)27/h2-6,11-13,17H,7-10H2,1H3,(H,24,28)

InChI Key

WMDYAGZUJUSDKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27457143

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.88

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.374

Distribution Coefficient, logD

3.374

Water Solubility, LogSw

-3.67

Polar Surface Area

51.003

Acid Dissociation Constant (pKa)

14.21

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

L486-0592 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L486-0592 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L486-0592?
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What is the minimum amount of L486-0592 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L486-0592
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L486-0592
  • 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 L486-0592 available by request