D090-0079 Screening compound: 6-chloro-N,9-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine

D090-0079 Screening compound: 6-chloro-N,9-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
D090-0079 Screening compound: 6-chloro-N,9-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D090-0079
6-chloro-N,9-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine

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

D090-0079

Molecular Formula

C14H17ClN2 (C14 H17 ClN2)

Compound Name

6-chloro-N,9-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine

IUPAC name

6-chloro-N9-dimethyl-2349-tetrahydro-1H-carbazol-1-amine

SMILES

CNC(CCC1)c2c1c(cc(cc1)Cl)c1n2C

InChI

InChI=1S/C14H17ClN2/c1-16-12-5-3-4-10-11-8-9(15)6-7-13(11)17(2)14(10)12/h6-8,12,16H,3-5H2,1-2H3/t12-/m0/s1

InChI Key

LVFYFGCLDWDTGS-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD01555676

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

248.76

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.416

Distribution Coefficient, logD

1.443

Water Solubility, LogSw

-3.83

Polar Surface Area

13.984

Acid Dissociation Constant (pKa)

24.85

Base Dissociation Constant (pKb)

9.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

D090-0079 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D090-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D090-0079?
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What is the minimum amount of D090-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D090-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D090-0079
  • 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 D090-0079 available by request