C200-9479 Screening compound: 8-METHYL-3-[(3-PROPYL-1,2,4-OXADIAZOL-5-YL)METHYL]-3H,4H,5H-PYRIMIDO[5,4-B]INDOL-4-ONE

C200-9479 Screening compound: 8-METHYL-3-[(3-PROPYL-1,2,4-OXADIAZOL-5-YL)METHYL]-3H,4H,5H-PYRIMIDO[5,4-B]INDOL-4-ONE
C200-9479 Screening compound: 8-METHYL-3-[(3-PROPYL-1,2,4-OXADIAZOL-5-YL)METHYL]-3H,4H,5H-PYRIMIDO[5,4-B]INDOL-4-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-9479
8-METHYL-3-[(3-PROPYL-1,2,4-OXADIAZOL-5-YL)METHYL]-3H,4H,5H-PYRIMIDO[5,4-B]INDOL-4-ONE

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

C200-9479

Molecular Formula

C17H17N5O2 (C17 H17 N5 O2)

Compound Name

8-METHYL-3-[(3-PROPYL-1,2,4-OXADIAZOL-5-YL)METHYL]-3H,4H,5H-PYRIMIDO[5,4-B]INDOL-4-ONE

IUPAC name

n/a

SMILES

CCCc1noc(CN(C=Nc2c3[nH]c4c2cc(C)cc4)C3=O)n1

InChI

InChI=1S/C17H17N5O2/c1-3-4-13-20-14(24-21-13)8-22-9-18-15-11-7-10(2)5-6-12(11)19-16(15)17(22)23/h5-7,9,19H,3-4,8H2,1-2H3

InChI Key

PBUIMYBXHLHZCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26962702

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.556

Distribution Coefficient, logD

2.556

Water Solubility, LogSw

-2.80

Polar Surface Area

66.902

Acid Dissociation Constant (pKa)

14.47

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

C200-9479 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C200-9479 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-9479?
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What is the minimum amount of C200-9479 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-9479
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-9479
  • 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 C200-9479 available by request