G621-0252 Screening compound: (1-benzyl-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-imidazol-5-yl)methanol

G621-0252 Screening compound: (1-benzyl-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-imidazol-5-yl)methanol
G621-0252 Screening compound: (1-benzyl-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-imidazol-5-yl)methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound G621-0252
(1-benzyl-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-imidazol-5-yl)methanol

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

G621-0252

Molecular Formula

C18H16ClFN2OS (C18 H16 ClFN2 OS)

Compound Name

(1-benzyl-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-imidazol-5-yl)methanol

IUPAC name

(1-benzyl-2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-imidazol-5-yl)methanol

SMILES

OCc(n1Cc2ccccc2)cnc1SCc(c(F)ccc1)c1Cl

InChI

InChI=1S/C18H16ClFN2OS/c19-16-7-4-8-17(20)15(16)12-24-18-21-9-14(11-23)22(18)10-13-5-2-1-3-6-13/h1-9,23H,10-12H2

InChI Key

QBYRESQSCOEGLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09023773

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.86

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.383

Distribution Coefficient, logD

4.382

Water Solubility, LogSw

-4.26

Polar Surface Area

28.359

Acid Dissociation Constant (pKa)

15.21

Base Dissociation Constant (pKb)

4.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

G621-0252 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G621-0252 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G621-0252?
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What is the minimum amount of G621-0252 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G621-0252
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G621-0252
  • 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 G621-0252 available by request