D103-1833 Screening compound: 7,8-dimethyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4H-chromene-2-carboxamide

D103-1833 Screening compound: 7,8-dimethyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4H-chromene-2-carboxamide
D103-1833 Screening compound: 7,8-dimethyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4H-chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D103-1833
7,8-dimethyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4H-chromene-2-carboxamide

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

D103-1833

Molecular Formula

C18H19N3O3S (C18 H19 N3 O3 S)

Compound Name

7,8-dimethyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-4H-chromene-2-carboxamide

IUPAC name

78-dimethyl-N-[5-(2-methylpropyl)-134-thiadiazol-2-yl]-4-oxo-4H-chromene-2-carboxamide

SMILES

CC(C)Cc1nnc(NC(C(Oc2c3ccc(C)c2C)=CC3=O)=O)s1

InChI

InChI=1S/C18H19N3O3S/c1-9(2)7-15-20-21-18(25-15)19-17(23)14-8-13(22)12-6-5-10(3)11(4)16(12)24-14/h5-6,8-9H,7H2,1-4H3,(H,19,21,23)

InChI Key

MYNFMNQLJIPIGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06791470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.703

Distribution Coefficient, logD

4.251

Water Solubility, LogSw

-4.41

Polar Surface Area

68.873

Acid Dissociation Constant (pKa)

7.14

Base Dissociation Constant (pKb)

-3.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D103-1833 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with D103-1833 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D103-1833?
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What is the minimum amount of D103-1833 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D103-1833
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D103-1833
  • 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 D103-1833 available by request