C700-2085 Screening compound: 2-(2-fluorobenzoyl)-1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

C700-2085 Screening compound: 2-(2-fluorobenzoyl)-1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole
C700-2085 Screening compound: 2-(2-fluorobenzoyl)-1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-2085
2-(2-fluorobenzoyl)-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

C700-2085

Molecular Formula

C25H20F2N2O2 (C25 H20 F2 N2 O2)

Compound Name

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

IUPAC name

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

SMILES

COc(cc1)cc2c1[nH]c(C1c(cc3)ccc3F)c2CCN1C(c(cccc1)c1F)=O

InChI

InChI=1S/C25H20F2N2O2/c1-31-17-10-11-22-20(14-17)18-12-13-29(25(30)19-4-2-3-5-21(19)27)24(23(18)28-22)15-6-8-16(26)9-7-15/h2-11,14,24,28H,12-13H2,1H3/t24-/m1/s1

InChI Key

BRMPNUKIGMXAHG-XMMPIXPASA-N

MDL Number (MFCD)

MFCD14785800

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.44

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

5.348

Distribution Coefficient, logD

5.348

Water Solubility, LogSw

-5.61

Polar Surface Area

33.615

Acid Dissociation Constant (pKa)

18.39

Base Dissociation Constant (pKb)

-3.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

C700-2085 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C700-2085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-2085?
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What is the minimum amount of C700-2085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-2085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-2085
  • 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 C700-2085 available by request