8009-5785 Screening compound: (4-chlorophenyl)(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)methanone

8009-5785 Screening compound: (4-chlorophenyl)(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)methanone
8009-5785 Screening compound: (4-chlorophenyl)(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-5785
(4-chlorophenyl)(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)methanone

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

8009-5785

Molecular Formula

C18H15ClN2O (C18 H15 ClN2 O)

Compound Name

(4-chlorophenyl)(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)methanone

IUPAC name

2-(4-chlorobenzoyl)-1H2H3H4H9H-pyrido[34-b]indole

SMILES

O=C(c(cc1)ccc1Cl)N(CC1)Cc2c1c(cccc1)c1[nH]2

InChI

InChI=1S/C18H15ClN2O/c19-13-7-5-12(6-8-13)18(22)21-10-9-15-14-3-1-2-4-16(14)20-17(15)11-21/h1-8,20H,9-11H2

InChI Key

AUHKJUTZZQZQOW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01417516

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.78

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.993

Distribution Coefficient, logD

2.993

Water Solubility, LogSw

-3.66

Polar Surface Area

27.399

Acid Dissociation Constant (pKa)

18.36

Base Dissociation Constant (pKb)

-3.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

8009-5785 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 8009-5785 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-5785?
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What is the minimum amount of 8009-5785 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-5785
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-5785
  • 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 8009-5785 available by request