G666-0159F Screening compound: N-[5-(4-methoxyphenyl)-1-methyl-1H-imidazol-2-yl]-N'-tetrahydro-2-furanylmethylurea

G666-0159F Screening compound: N-[5-(4-methoxyphenyl)-1-methyl-1H-imidazol-2-yl]-N'-tetrahydro-2-furanylmethylurea
G666-0159F Screening compound: N-[5-(4-methoxyphenyl)-1-methyl-1H-imidazol-2-yl]-N'-tetrahydro-2-furanylmethylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound G666-0159F
N-[5-(4-methoxyphenyl)-1-methyl-1H-imidazol-2-yl]-N'-tetrahydro-2-furanylmethylurea

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

G666-0159F

Molecular Formula

C17H22N4O3 (C17 H22 N4 O3)

Compound Name

N-[5-(4-methoxyphenyl)-1-methyl-1H-imidazol-2-yl]-N'-tetrahydro-2-furanylmethylurea

IUPAC name

3-[5-(4-methoxyphenyl)-1-methyl-1H-imidazol-2-yl]-1-[(oxolan-2-yl)methyl]urea

SMILES

Cn1c(NC(NCC2OCCC2)=O)ncc1-c(cc1)ccc1OC

InChI

InChI=1S/C17H22N4O3/c1-21-15(12-5-7-13(23-2)8-6-12)11-18-16(21)20-17(22)19-10-14-4-3-9-24-14/h5-8,11,14H,3-4,9-10H2,1-2H3,(H2,18,19,20,22)

InChI Key

AHTQPVNYEHZAMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15027451

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.130

Distribution Coefficient, logD

1.891

Water Solubility, LogSw

-2.66

Polar Surface Area

62.993

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

7.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.18

G666-0159F in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G666-0159F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G666-0159F?
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What is the minimum amount of G666-0159F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G666-0159F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G666-0159F
  • 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 G666-0159F available by request