L486-0136 Screening compound: 6-chloro-3-[1-(2,5-dimethoxybenzenesulfonyl)piperidin-4-yl]-3,4-dihydroquinazolin-4-one

L486-0136 Screening compound: 6-chloro-3-[1-(2,5-dimethoxybenzenesulfonyl)piperidin-4-yl]-3,4-dihydroquinazolin-4-one
L486-0136 Screening compound: 6-chloro-3-[1-(2,5-dimethoxybenzenesulfonyl)piperidin-4-yl]-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L486-0136
6-chloro-3-[1-(2,5-dimethoxybenzenesulfonyl)piperidin-4-yl]-3,4-dihydroquinazolin-4-one

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

L486-0136

Molecular Formula

C21H22ClN3O5S (C21 H22 ClN3 O5 S)

Compound Name

6-chloro-3-[1-(2,5-dimethoxybenzenesulfonyl)piperidin-4-yl]-3,4-dihydroquinazolin-4-one

IUPAC name

6-chloro-3-[1-(25-dimethoxybenzenesulfonyl)piperidin-4-yl]-34-dihydroquinazolin-4-one

SMILES

COc(cc1)cc(S(N(CC2)CCC2N(C=Nc(cc2)c3cc2Cl)C3=O)(=O)=O)c1OC

InChI

InChI=1S/C21H22ClN3O5S/c1-29-16-4-6-19(30-2)20(12-16)31(27,28)24-9-7-15(8-10-24)25-13-23-18-5-3-14(22)11-17(18)21(25)26/h3-6,11-13,15H,7-10H2,1-2H3

InChI Key

VLWQPOVFGBPDEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27456996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.94

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.944

Distribution Coefficient, logD

2.944

Water Solubility, LogSw

-3.43

Polar Surface Area

72.419

Acid Dissociation Constant (pKa)

27.88

Base Dissociation Constant (pKb)

1.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L486-0136 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L486-0136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L486-0136?
Check Price and Availability of L486-0136, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L486-0136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L486-0136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L486-0136
  • 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 L486-0136 available by request