V026-1697 Screening compound: N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-(prop-2-en-1-yl)cyclopropanecarboxamide

V026-1697 Screening compound: N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-(prop-2-en-1-yl)cyclopropanecarboxamide
V026-1697 Screening compound: N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-(prop-2-en-1-yl)cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-1697
N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-(prop-2-en-1-yl)cyclopropanecarboxamide

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

V026-1697

Molecular Formula

C17H19ClN2O2 (C17 H19 ClN2 O2)

Compound Name

N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-(prop-2-en-1-yl)cyclopropanecarboxamide

IUPAC name

N-{[3-(4-chlorophenyl)-45-dihydro-12-oxazol-5-yl]methyl}-N-(prop-2-en-1-yl)cyclopropanecarboxamide

SMILES

C=CCN(CC(C1)ON=C1c(cc1)ccc1Cl)C(C1CC1)=O

InChI

InChI=1S/C17H19ClN2O2/c1-2-9-20(17(21)13-3-4-13)11-15-10-16(19-22-15)12-5-7-14(18)8-6-12/h2,5-8,13,15H,1,3-4,9-11H2/t15-/m0/s1

InChI Key

AQEHRNIDIUCGMD-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD10452044

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

318.8

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.627

Distribution Coefficient, logD

3.627

Water Solubility, LogSw

-4.06

Polar Surface Area

39.787

Acid Dissociation Constant (pKa)

22.29

Base Dissociation Constant (pKb)

4.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

V026-1697 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V026-1697 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-1697?
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What is the minimum amount of V026-1697 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-1697
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-1697
  • 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 V026-1697 available by request