F066-0355 Screening compound: N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-methyl-1,2-oxazole-3-carboxamide

F066-0355 Screening compound: N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-methyl-1,2-oxazole-3-carboxamide
F066-0355 Screening compound: N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-methyl-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F066-0355
N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-methyl-1,2-oxazole-3-carboxamide

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

F066-0355

Molecular Formula

C21H25N3O4S (C21 H25 N3 O4 S)

Compound Name

N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-methyl-1,2-oxazole-3-carboxamide

IUPAC name

N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-methyl-12-oxazole-3-carboxamide

SMILES

Cc1cc(C(Nc(cc2)ccc2S(NC2(CC(C3)C4)CC4CC3C2)(=O)=O)=O)no1

InChI

InChI=1S/C21H25N3O4S/c1-13-6-19(23-28-13)20(25)22-17-2-4-18(5-3-17)29(26,27)24-21-10-14-7-15(11-21)9-16(8-14)12-21/h2-6,14-16,24H,7-12H2,1H3,(H,22,25)

InChI Key

SBCSUPDNBSBNBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06759981

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.871

Distribution Coefficient, logD

3.869

Water Solubility, LogSw

-4.08

Polar Surface Area

86.225

Acid Dissociation Constant (pKa)

9.71

Base Dissociation Constant (pKb)

-4.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.40

F066-0355 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F066-0355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F066-0355?
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What is the minimum amount of F066-0355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F066-0355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F066-0355
  • 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 F066-0355 available by request