L110-0708 Screening compound: 1-{[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

L110-0708 Screening compound: 1-{[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione
L110-0708 Screening compound: 1-{[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound L110-0708
1-{[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

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

L110-0708

Molecular Formula

C22H19ClN4O4 (C22 H19 ClN4 O4)

Compound Name

1-{[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

IUPAC name

1-{[3-(3-chlorophenyl)-124-oxadiazol-5-yl]methyl}-3-[(oxolan-2-yl)methyl]-1234-tetrahydroquinazoline-24-dione

SMILES

O=C(c(cccc1)c1N1Cc2nc(-c3cccc(Cl)c3)no2)N(CC2OCCC2)C1=O

InChI

InChI=1S/C22H19ClN4O4/c23-15-6-3-5-14(11-15)20-24-19(31-25-20)13-26-18-9-2-1-8-17(18)21(28)27(22(26)29)12-16-7-4-10-30-16/h1-3,5-6,8-9,11,16H,4,7,10,12-13H2/t16-/m1/s1

InChI Key

AAQFYINPERQKAM-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD11999204

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.87

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.737

Distribution Coefficient, logD

3.737

Water Solubility, LogSw

-4.24

Polar Surface Area

71.264

Acid Dissociation Constant (pKa)

26.48

Base Dissociation Constant (pKb)

-6.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

L110-0708 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 L110-0708 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L110-0708?
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What is the minimum amount of L110-0708 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L110-0708
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L110-0708
  • 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 L110-0708 available by request