G621-0418 Screening compound: 2-{[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide

G621-0418 Screening compound: 2-{[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
G621-0418 Screening compound: 2-{[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G621-0418
2-{[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide

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

G621-0418

Molecular Formula

C21H23N3O3S (C21 H23 N3 O3 S)

Compound Name

2-{[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide

IUPAC name

2-{[5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide

SMILES

Cc1cccc(NC(CSc2ncc(CO)n2Cc(cc2)ccc2OC)=O)c1

InChI

InChI=1S/C21H23N3O3S/c1-15-4-3-5-17(10-15)23-20(26)14-28-21-22-11-18(13-25)24(21)12-16-6-8-19(27-2)9-7-16/h3-11,25H,12-14H2,1-2H3,(H,23,26)

InChI Key

ZKOBFWHYTAKBRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09023877

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.374

Distribution Coefficient, logD

3.374

Water Solubility, LogSw

-3.41

Polar Surface Area

59.052

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with G621-0418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G621-0418?
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What is the minimum amount of G621-0418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G621-0418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G621-0418
  • 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 G621-0418 available by request