G642-1811 Screening compound: 3-[4-acetyl-5-(9-ethyl-9H-carbazol-3-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]naphthalen-2-yl acetate

G642-1811 Screening compound: 3-[4-acetyl-5-(9-ethyl-9H-carbazol-3-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]naphthalen-2-yl acetate
G642-1811 Screening compound: 3-[4-acetyl-5-(9-ethyl-9H-carbazol-3-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]naphthalen-2-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-1811
3-[4-acetyl-5-(9-ethyl-9H-carbazol-3-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]naphthalen-2-yl acetate

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

G642-1811

Molecular Formula

C30H25N3O4 (C30 H25 N3 O4)

Compound Name

3-[4-acetyl-5-(9-ethyl-9H-carbazol-3-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]naphthalen-2-yl acetate

IUPAC name

3-[4-acetyl-5-(9-ethyl-9H-carbazol-3-yl)-45-dihydro-134-oxadiazol-2-yl]naphthalen-2-yl acetate

SMILES

CCn1c(ccc(C2OC(c3cc4ccccc4cc3OC(C)=O)=NN2C(C)=O)c2)c2c2c1cccc2

InChI

InChI=1S/C30H25N3O4/c1-4-32-26-12-8-7-11-23(26)24-16-22(13-14-27(24)32)30-33(18(2)34)31-29(37-30)25-15-20-9-5-6-10-21(20)17-28(25)36-19(3)35/h5-17,30H,4H2,1-3H3/t30-/m1/s1

InChI Key

KMOPZHGRACOVCP-SSEXGKCCSA-N

MDL Number (MFCD)

MFCD15025298

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.421

Distribution Coefficient, logD

6.421

Water Solubility, LogSw

-6.62

Polar Surface Area

56.517

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

0.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

G642-1811 in Drug Discovery

Included in Screening Libraries

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

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G642-1811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-1811?
Check Price and Availability of G642-1811, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G642-1811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-1811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-1811
  • 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 G642-1811 available by request