L110-0952 Screening compound: methyl 2-(1-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate

L110-0952 Screening compound: methyl 2-(1-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate
L110-0952 Screening compound: methyl 2-(1-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L110-0952
methyl 2-(1-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate

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

L110-0952

Molecular Formula

C27H22N4O6 (C27 H22 N4 O6)

Compound Name

methyl 2-(1-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate

IUPAC name

methyl 2-(1-{[3-(4-ethoxyphenyl)-124-oxadiazol-5-yl]methyl}-24-dioxo-1234-tetrahydroquinazolin-3-yl)benzoate

SMILES

CCOc(cc1)ccc1-c1noc(CN(c(cccc2)c2C(N2c(cccc3)c3C(OC)=O)=O)C2=O)n1

InChI

InChI=1S/C27H22N4O6/c1-3-36-18-14-12-17(13-15-18)24-28-23(37-29-24)16-30-21-10-6-4-8-19(21)25(32)31(27(30)34)22-11-7-5-9-20(22)26(33)35-2/h4-15H,3,16H2,1-2H3

InChI Key

WJDZDEPPEGGFAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27232794

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.5

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.353

Distribution Coefficient, logD

4.353

Water Solubility, LogSw

-4.35

Polar Surface Area

89.995

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-7.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

L110-0952 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L110-0952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L110-0952?
Check Price and Availability of L110-0952, 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 L110-0952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L110-0952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L110-0952
  • 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 L110-0952 available by request