L110-0951 Screening compound: methyl 2-(1-{[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate

L110-0951 Screening compound: methyl 2-(1-{[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate
L110-0951 Screening compound: methyl 2-(1-{[3-(2-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 L110-0951
methyl 2-(1-{[3-(2-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

L110-0951

Molecular Formula

C27H22N4O6 (C27 H22 N4 O6)

Compound Name

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

SMILES

CCOc(cccc1)c1-c1noc(CN(c(cccc2)c2C(N2c(cccc3)c3C(OC)=O)=O)C2=O)n1

InChI

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

InChI Key

GUVHRNAQEOSQKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16638021

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

3.971

Distribution Coefficient, logD

3.971

Water Solubility, LogSw

-4.22

Polar Surface Area

90.082

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-7.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

References: we are preparing a list of scientific research reports with L110-0951 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L110-0951?
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What is the minimum amount of L110-0951 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L110-0951
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L110-0951
  • 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 L110-0951 available by request