L110-0957 Screening compound: ethyl 2-(1-{[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate

L110-0957 Screening compound: ethyl 2-(1-{[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)benzoate
L110-0957 Screening compound: ethyl 2-(1-{[3-(2-methylphenyl)-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 L110-0957
ethyl 2-(1-{[3-(2-methylphenyl)-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

L110-0957

Molecular Formula

C27H22N4O5 (C27 H22 N4 O5)

Compound Name

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

IUPAC name

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

SMILES

CCOC(c(cccc1)c1N(C(c(cccc1)c1N1Cc2nc(-c3c(C)cccc3)no2)=O)C1=O)=O

InChI

InChI=1S/C27H22N4O5/c1-3-35-26(33)20-13-7-9-15-22(20)31-25(32)19-12-6-8-14-21(19)30(27(31)34)16-23-28-24(29-36-23)18-11-5-4-10-17(18)2/h4-15H,3,16H2,1-2H3

InChI Key

BPABRFRPQFMFCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27232797

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.545

Distribution Coefficient, logD

4.545

Water Solubility, LogSw

-4.40

Polar Surface Area

82.451

Acid Dissociation Constant (pKa)

28.18

Base Dissociation Constant (pKb)

-7.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

References: we are preparing a list of scientific research reports with L110-0957 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L110-0957?
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What is the minimum amount of L110-0957 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L110-0957
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L110-0957
  • 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 L110-0957 available by request