Z632-2642 Screening compound: 4-cyano-N-[(3,5-dimethyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]benzamide

Z632-2642 Screening compound: 4-cyano-N-[(3,5-dimethyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]benzamide
Z632-2642 Screening compound: 4-cyano-N-[(3,5-dimethyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Z632-2642
4-cyano-N-[(3,5-dimethyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]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

Z632-2642

Molecular Formula

C14H15N3O2 (C14 H15 N3 O2)

Compound Name

4-cyano-N-[(3,5-dimethyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]benzamide

IUPAC name

4-cyano-N-[(35-dimethyl-45-dihydro-12-oxazol-5-yl)methyl]benzamide

SMILES

CC1(CNC(c(cc2)ccc2C#N)=O)ON=C(C)C1

InChI

InChI=1S/C14H15N3O2/c1-10-7-14(2,19-17-10)9-16-13(18)12-5-3-11(8-15)4-6-12/h3-6H,7,9H2,1-2H3,(H,16,18)/t14-/m1/s1

InChI Key

XPJNIDVXIFIMCK-CQSZACIVSA-N

MDL Number (MFCD)

MFCD27640816

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

257.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.545

Distribution Coefficient, logD

1.545

Water Solubility, LogSw

-2.03

Polar Surface Area

63.286

Acid Dissociation Constant (pKa)

13.96

Base Dissociation Constant (pKb)

-2.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

Z632-2642 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with Z632-2642 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z632-2642?
Check Price and Availability of Z632-2642, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Z632-2642 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z632-2642
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z632-2642
  • 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 Z632-2642 available by request