V003-9626 Screening compound: N-[3-(4-CHLOROPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]CYCLOHEXANECARBOXAMIDE

V003-9626 Screening compound: N-[3-(4-CHLOROPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]CYCLOHEXANECARBOXAMIDE
V003-9626 Screening compound: N-[3-(4-CHLOROPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]CYCLOHEXANECARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-9626
N-[3-(4-CHLOROPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]CYCLOHEXANECARBOXAMIDE

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

V003-9626

Molecular Formula

C17H20ClN3O (C17 H20 ClN3 O)

Compound Name

N-[3-(4-CHLOROPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]CYCLOHEXANECARBOXAMIDE

IUPAC name

n/a

SMILES

Cc([nH]nc1-c(cc2)ccc2Cl)c1NC(C1CCCCC1)=O

InChI

InChI=1S/C17H20ClN3O/c1-11-15(19-17(22)13-5-3-2-4-6-13)16(21-20-11)12-7-9-14(18)10-8-12/h7-10,13H,2-6H2,1H3,(H,19,22)(H,20,21)

InChI Key

XCGUJASUPILICZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14266239

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

317.82

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.851

Distribution Coefficient, logD

3.851

Water Solubility, LogSw

-4.33

Polar Surface Area

45.963

Acid Dissociation Constant (pKa)

11.46

Base Dissociation Constant (pKb)

-1.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.00

V003-9626 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with V003-9626 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-9626?
Check Price and Availability of V003-9626, 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 V003-9626 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-9626
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-9626
  • 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 V003-9626 available by request