T993-0093 Screening compound: N-{[5-METHYL-4-(PYRROLIDINE-1-CARBONYL)-1,3-OXAZOL-2-YL]METHYL}-2-(TRIFLUOROMETHOXY)BENZAMIDE

T993-0093 Screening compound: N-{[5-METHYL-4-(PYRROLIDINE-1-CARBONYL)-1,3-OXAZOL-2-YL]METHYL}-2-(TRIFLUOROMETHOXY)BENZAMIDE
T993-0093 Screening compound: N-{[5-METHYL-4-(PYRROLIDINE-1-CARBONYL)-1,3-OXAZOL-2-YL]METHYL}-2-(TRIFLUOROMETHOXY)BENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound T993-0093
N-{[5-METHYL-4-(PYRROLIDINE-1-CARBONYL)-1,3-OXAZOL-2-YL]METHYL}-2-(TRIFLUOROMETHOXY)BENZAMIDE

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

T993-0093

Molecular Formula

C18H18F3N3O4 (C18 H18 F3 N3 O4)

Compound Name

N-{[5-METHYL-4-(PYRROLIDINE-1-CARBONYL)-1,3-OXAZOL-2-YL]METHYL}-2-(TRIFLUOROMETHOXY)BENZAMIDE

IUPAC name

N-{[5-methyl-4-(pyrrolidine-1-carbonyl)-13-oxazol-2-yl]methyl}-2-(trifluoromethoxy)benzamide

SMILES

Cc1c(C(N2CCCC2)=O)nc(CNC(c(cccc2)c2OC(F)(F)F)=O)o1

InChI

InChI=1S/C18H18F3N3O4/c1-11-15(17(26)24-8-4-5-9-24)23-14(27-11)10-22-16(25)12-6-2-3-7-13(12)28-18(19,20)21/h2-3,6-7H,4-5,8-10H2,1H3,(H,22,25)

InChI Key

NBSFZGILKUNKIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29028934

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.401

Distribution Coefficient, logD

3.400

Water Solubility, LogSw

-3.81

Polar Surface Area

65.253

Acid Dissociation Constant (pKa)

10.30

Base Dissociation Constant (pKb)

-3.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

T993-0093 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with T993-0093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T993-0093?
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What is the minimum amount of T993-0093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T993-0093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T993-0093
  • 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 T993-0093 available by request