C700-2087 Screening compound: 1-(4-fluorophenyl)-6-methoxy-2-(4-methylbenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

C700-2087 Screening compound: 1-(4-fluorophenyl)-6-methoxy-2-(4-methylbenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole
C700-2087 Screening compound: 1-(4-fluorophenyl)-6-methoxy-2-(4-methylbenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-2087
1-(4-fluorophenyl)-6-methoxy-2-(4-methylbenzoyl)-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

C700-2087

Molecular Formula

C26H23FN2O2 (C26 H23 FN2 O2)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1C(N(CCc1c2[nH]c(cc3)c1cc3OC)C2c(cc1)ccc1F)=O

InChI

InChI=1S/C26H23FN2O2/c1-16-3-5-18(6-4-16)26(30)29-14-13-21-22-15-20(31-2)11-12-23(22)28-24(21)25(29)17-7-9-19(27)10-8-17/h3-12,15,25,28H,13-14H2,1-2H3/t25-/m1/s1

InChI Key

SJEMRTUSXNRDCL-RUZDIDTESA-N

MDL Number (MFCD)

MFCD14785802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.48

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

5.722

Distribution Coefficient, logD

5.722

Water Solubility, LogSw

-5.62

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

19.20

C700-2087 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C700-2087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-2087?
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What is the minimum amount of C700-2087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-2087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-2087
  • 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 C700-2087 available by request