V017-1373 Screening compound: 1-(3,4-dichlorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3-chloro-2,2-dimethylpropanoate

V017-1373 Screening compound: 1-(3,4-dichlorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3-chloro-2,2-dimethylpropanoate
V017-1373 Screening compound: 1-(3,4-dichlorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3-chloro-2,2-dimethylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-1373
1-(3,4-dichlorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3-chloro-2,2-dimethylpropanoate

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

V017-1373

Molecular Formula

C17H19Cl3N2O2 (C17 H19 Cl3 N2 O2)

Compound Name

1-(3,4-dichlorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3-chloro-2,2-dimethylpropanoate

IUPAC name

1-(34-dichlorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3-chloro-22-dimethylpropanoate

SMILES

CC(C)c(cc1OC(C(C)(C)CCl)=O)nn1-c(cc1)cc(Cl)c1Cl

InChI

InChI=1S/C17H19Cl3N2O2/c1-10(2)14-8-15(24-16(23)17(3,4)9-18)22(21-14)11-5-6-12(19)13(20)7-11/h5-8,10H,9H2,1-4H3

InChI Key

LMTKDEHGWPMITH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19713467

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.71

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.046

Distribution Coefficient, logD

6.046

Water Solubility, LogSw

-6.20

Polar Surface Area

34.382

Acid Dissociation Constant (pKa)

27.26

Base Dissociation Constant (pKb)

-0.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

V017-1373 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V017-1373 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-1373?
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What is the minimum amount of V017-1373 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-1373
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-1373
  • 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 V017-1373 available by request