T993-1137 Screening compound: 1-[(4-fluorophenyl)methyl]-3-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}urea

T993-1137 Screening compound: 1-[(4-fluorophenyl)methyl]-3-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}urea
T993-1137 Screening compound: 1-[(4-fluorophenyl)methyl]-3-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound T993-1137
1-[(4-fluorophenyl)methyl]-3-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}urea

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

T993-1137

Molecular Formula

C20H25FN4O3 (C20 H25 FN4 O3)

Compound Name

1-[(4-fluorophenyl)methyl]-3-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl}urea

IUPAC name

1-[(4-fluorophenyl)methyl]-3-{[5-methyl-4-(4-methylpiperidine-1-carbonyl)-13-oxazol-2-yl]methyl}urea

SMILES

CC(CC1)CCN1C(c1c(C)oc(CNC(NCc(cc2)ccc2F)=O)n1)=O

InChI

InChI=1S/C20H25FN4O3/c1-13-7-9-25(10-8-13)19(26)18-14(2)28-17(24-18)12-23-20(27)22-11-15-3-5-16(21)6-4-15/h3-6,13H,7-12H2,1-2H3,(H2,22,23,27)

InChI Key

UVCNZPFOXYSXDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29031974

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.077

Distribution Coefficient, logD

2.077

Water Solubility, LogSw

-2.58

Polar Surface Area

69.398

Acid Dissociation Constant (pKa)

13.82

Base Dissociation Constant (pKb)

-1.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

T993-1137 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Antibacterial Compounds Library (13827 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with T993-1137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T993-1137?
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What is the minimum amount of T993-1137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T993-1137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T993-1137
  • 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 T993-1137 available by request