T993-1249 Screening compound: 3,5-difluoro-N-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}benzene-1-sulfonamide

T993-1249 Screening compound: 3,5-difluoro-N-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}benzene-1-sulfonamide
T993-1249 Screening compound: 3,5-difluoro-N-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T993-1249
3,5-difluoro-N-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}benzene-1-sulfonamide

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

T993-1249

Molecular Formula

C18H21F2N3O4S (C18 H21 F2 N3 O4 S)

Compound Name

3,5-difluoro-N-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}benzene-1-sulfonamide

IUPAC name

35-difluoro-N-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-13-oxazol-2-yl]methyl}benzene-1-sulfonamide

SMILES

CC(CC1)CCN1C(c1c(C)oc(CNS(c2cc(F)cc(F)c2)(=O)=O)n1)=O

InChI

InChI=1S/C18H21F2N3O4S/c1-11-3-5-23(6-4-11)18(24)17-12(2)27-16(22-17)10-21-28(25,26)15-8-13(19)7-14(20)9-15/h7-9,11,21H,3-6,10H2,1-2H3

InChI Key

ZVGHFKQUIGRELA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29029131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.911

Distribution Coefficient, logD

2.909

Water Solubility, LogSw

-3.42

Polar Surface Area

76.209

Acid Dissociation Constant (pKa)

9.77

Base Dissociation Constant (pKb)

-1.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

T993-1249 in Drug Discovery

Included in Screening Libraries

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with T993-1249 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T993-1249?
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What is the minimum amount of T993-1249 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T993-1249
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T993-1249
  • 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 T993-1249 available by request