V010-4449 Screening compound: 5-(2H-1,3-benzodioxol-5-yl)-N-(3,3,5-trimethylcyclohexyl)-1,2-oxazole-3-carboxamide

V010-4449 Screening compound: 5-(2H-1,3-benzodioxol-5-yl)-N-(3,3,5-trimethylcyclohexyl)-1,2-oxazole-3-carboxamide
V010-4449 Screening compound: 5-(2H-1,3-benzodioxol-5-yl)-N-(3,3,5-trimethylcyclohexyl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-4449
5-(2H-1,3-benzodioxol-5-yl)-N-(3,3,5-trimethylcyclohexyl)-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

V010-4449

Molecular Formula

C20H24N2O4 (C20 H24 N2 O4)

Compound Name

5-(2H-1,3-benzodioxol-5-yl)-N-(3,3,5-trimethylcyclohexyl)-1,2-oxazole-3-carboxamide

IUPAC name

5-(2H-13-benzodioxol-5-yl)-N-(335-trimethylcyclohexyl)-12-oxazole-3-carboxamide

SMILES

CC(C1)CC(C)(C)CC1NC(c1noc(-c(cc2)cc3c2OCO3)c1)=O

InChI

InChI=1S/C20H24N2O4/c1-12-6-14(10-20(2,3)9-12)21-19(23)15-8-17(26-22-15)13-4-5-16-18(7-13)25-11-24-16/h4-5,7-8,12,14H,6,9-11H2,1-3H3,(H,21,23)

InChI Key

FAHSSWBJSYWINV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19954927

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.474

Distribution Coefficient, logD

4.474

Water Solubility, LogSw

-4.34

Polar Surface Area

63.028

Acid Dissociation Constant (pKa)

13.52

Base Dissociation Constant (pKb)

-2.58

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with V010-4449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-4449?
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What is the minimum amount of V010-4449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-4449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-4449
  • 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 V010-4449 available by request