C700-2084 Screening compound: 2-cyclopropanecarbonyl-1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

C700-2084 Screening compound: 2-cyclopropanecarbonyl-1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole
C700-2084 Screening compound: 2-cyclopropanecarbonyl-1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-2084
2-cyclopropanecarbonyl-1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

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

C700-2084

Molecular Formula

C22H21FN2O2 (C22 H21 FN2 O2)

Compound Name

2-cyclopropanecarbonyl-1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

IUPAC name

2-cyclopropanecarbonyl-1-(4-fluorophenyl)-6-methoxy-1H2H3H4H9H-pyrido[34-b]indole

SMILES

COc(cc1)cc2c1[nH]c(C1c(cc3)ccc3F)c2CCN1C(C1CC1)=O

InChI

InChI=1S/C22H21FN2O2/c1-27-16-8-9-19-18(12-16)17-10-11-25(22(26)14-2-3-14)21(20(17)24-19)13-4-6-15(23)7-5-13/h4-9,12,14,21,24H,2-3,10-11H2,1H3/t21-/m1/s1

InChI Key

VERSATYCKRXXDV-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD14785799

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.514

Distribution Coefficient, logD

4.514

Water Solubility, LogSw

-4.36

Polar Surface Area

34.138

Acid Dissociation Constant (pKa)

18.39

Base Dissociation Constant (pKb)

-3.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

C700-2084 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

DGK Inhibitors Library (10558 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C700-2084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-2084?
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What is the minimum amount of C700-2084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-2084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-2084
  • 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 C700-2084 available by request