G535-0427 Screening compound: 2-(4-chlorophenyl)-4-({3-ethyl-2-methyl-7-phenyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-6-yl}methyl)-5-methyl-1,3-oxazole

G535-0427 Screening compound: 2-(4-chlorophenyl)-4-({3-ethyl-2-methyl-7-phenyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-6-yl}methyl)-5-methyl-1,3-oxazole
G535-0427 Screening compound: 2-(4-chlorophenyl)-4-({3-ethyl-2-methyl-7-phenyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-6-yl}methyl)-5-methyl-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound G535-0427
2-(4-chlorophenyl)-4-({3-ethyl-2-methyl-7-phenyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-6-yl}methyl)-5-methyl-1,3-oxazole

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

G535-0427

Molecular Formula

C27H27ClN2OS (C27 H27 ClN2 OS)

Compound Name

2-(4-chlorophenyl)-4-({3-ethyl-2-methyl-7-phenyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-6-yl}methyl)-5-methyl-1,3-oxazole

IUPAC name

2-(4-chlorophenyl)-4-({3-ethyl-2-methyl-7-phenyl-4H5H6H7H-thieno[23-c]pyridin-6-yl}methyl)-5-methyl-13-oxazole

SMILES

CCc1c(C)sc2c1CCN(Cc1c(C)oc(-c(cc3)ccc3Cl)n1)C2c1ccccc1

InChI

InChI=1S/C27H27ClN2OS/c1-4-22-18(3)32-26-23(22)14-15-30(25(26)19-8-6-5-7-9-19)16-24-17(2)31-27(29-24)20-10-12-21(28)13-11-20/h5-13,25H,4,14-16H2,1-3H3/t25-/m1/s1

InChI Key

QRQUPFUVNJGUDI-RUZDIDTESA-N

MDL Number (MFCD)

MFCD15017077

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.04

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.641

Distribution Coefficient, logD

7.496

Water Solubility, LogSw

-6.61

Polar Surface Area

22.252

Acid Dissociation Constant (pKa)

25.66

Base Dissociation Constant (pKb)

7.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

G535-0427 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G535-0427 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G535-0427?
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What is the minimum amount of G535-0427 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G535-0427
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G535-0427
  • 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 G535-0427 available by request