S932-7390 Screening compound: 2-{[1-(1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}pyrrolidin-3-yl)-1H-1,2,3-triazol-4-yl]methoxy}pyrazine

S932-7390 Screening compound: 2-{[1-(1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}pyrrolidin-3-yl)-1H-1,2,3-triazol-4-yl]methoxy}pyrazine
S932-7390 Screening compound: 2-{[1-(1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}pyrrolidin-3-yl)-1H-1,2,3-triazol-4-yl]methoxy}pyrazine alternative view

Chemical Structure Depiction of ChemDiv screening compound S932-7390
2-{[1-(1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}pyrrolidin-3-yl)-1H-1,2,3-triazol-4-yl]methoxy}pyrazine

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

S932-7390

Molecular Formula

C20H20N8O3 (C20 H20 N8 O3)

Compound Name

2-{[1-(1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}pyrrolidin-3-yl)-1H-1,2,3-triazol-4-yl]methoxy}pyrazine

IUPAC name

n/a

SMILES

O=C(c1ccc(Cn2cncc2)o1)N(CC1)CC1n1nnc(COc2nccnc2)c1

InChI

InChI=1S/C20H20N8O3/c29-20(18-2-1-17(31-18)12-26-8-6-22-14-26)27-7-3-16(11-27)28-10-15(24-25-28)13-30-19-9-21-4-5-23-19/h1-2,4-6,8-10,14,16H,3,7,11-13H2/t16-/m1/s1

InChI Key

RKZAYVCQTYLYNZ-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD31999206

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.489

Distribution Coefficient, logD

0.467

Water Solubility, LogSw

-0.85

Polar Surface Area

89.773

Acid Dissociation Constant (pKa)

24.44

Base Dissociation Constant (pKb)

6.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

S932-7390 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 S932-7390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S932-7390?
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What is the minimum amount of S932-7390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S932-7390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S932-7390
  • 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 S932-7390 available by request