G790-1191 Screening compound: methyl 5-[(butan-2-yl)amino]-3-(3-chlorophenyl)-1,2-oxazole-4-carboxylate

G790-1191 Screening compound: methyl 5-[(butan-2-yl)amino]-3-(3-chlorophenyl)-1,2-oxazole-4-carboxylate
G790-1191 Screening compound: methyl 5-[(butan-2-yl)amino]-3-(3-chlorophenyl)-1,2-oxazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G790-1191
methyl 5-[(butan-2-yl)amino]-3-(3-chlorophenyl)-1,2-oxazole-4-carboxylate

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

G790-1191

Molecular Formula

C15H17ClN2O3 (C15 H17 ClN2 O3)

Compound Name

methyl 5-[(butan-2-yl)amino]-3-(3-chlorophenyl)-1,2-oxazole-4-carboxylate

IUPAC name

methyl 5-[(butan-2-yl)amino]-3-(3-chlorophenyl)-12-oxazole-4-carboxylate

SMILES

CCC(C)Nc1c(C(OC)=O)c(-c2cccc(Cl)c2)no1

InChI

InChI=1S/C15H17ClN2O3/c1-4-9(2)17-14-12(15(19)20-3)13(18-21-14)10-6-5-7-11(16)8-10/h5-9,17H,4H2,1-3H3/t9-/m0/s1

InChI Key

WSAFDAYNXGKCTH-VIFPVBQESA-N

MDL Number (MFCD)

MFCD27158213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.76

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.730

Distribution Coefficient, logD

3.730

Water Solubility, LogSw

-4.60

Polar Surface Area

53.946

Acid Dissociation Constant (pKa)

17.03

Base Dissociation Constant (pKb)

-3.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

G790-1191 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS MPO Library (28609 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G790-1191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G790-1191?
Check Price and Availability of G790-1191, 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 G790-1191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G790-1191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G790-1191
  • 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 G790-1191 available by request