G339-0552 Screening compound: 1-[(4-CHLOROPHENYL)METHYL]-N-[2-(2-METHYLPIPERIDIN-1-YL)ETHYL]-1H-INDAZOLE-6-CARBOXAMIDE

G339-0552 Screening compound: 1-[(4-CHLOROPHENYL)METHYL]-N-[2-(2-METHYLPIPERIDIN-1-YL)ETHYL]-1H-INDAZOLE-6-CARBOXAMIDE
G339-0552 Screening compound: 1-[(4-CHLOROPHENYL)METHYL]-N-[2-(2-METHYLPIPERIDIN-1-YL)ETHYL]-1H-INDAZOLE-6-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G339-0552
1-[(4-CHLOROPHENYL)METHYL]-N-[2-(2-METHYLPIPERIDIN-1-YL)ETHYL]-1H-INDAZOLE-6-CARBOXAMIDE

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

G339-0552

Molecular Formula

C23H27ClN4O (C23 H27 ClN4 O)

Compound Name

1-[(4-CHLOROPHENYL)METHYL]-N-[2-(2-METHYLPIPERIDIN-1-YL)ETHYL]-1H-INDAZOLE-6-CARBOXAMIDE

IUPAC name

n/a

SMILES

CC1N(CCNC(c2cc(n(Cc(cc3)ccc3Cl)nc3)c3cc2)=O)CCCC1

InChI

InChI=1S/C23H27ClN4O/c1-17-4-2-3-12-27(17)13-11-25-23(29)19-7-8-20-15-26-28(22(20)14-19)16-18-5-9-21(24)10-6-18/h5-10,14-15,17H,2-4,11-13,16H2,1H3,(H,25,29)/t17-/m0/s1

InChI Key

JTQIMXIRPCYUGB-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27135937

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.95

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.675

Distribution Coefficient, logD

2.442

Water Solubility, LogSw

-4.10

Polar Surface Area

41.358

Acid Dissociation Constant (pKa)

13.43

Base Dissociation Constant (pKb)

8.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

G339-0552 in Drug Discovery

Included in Screening Libraries

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with G339-0552 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G339-0552?
Check Price and Availability of G339-0552, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G339-0552 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G339-0552
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G339-0552
  • 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 G339-0552 available by request