V004-7277 Screening compound: N-[3-(4-chlorophenyl)-5-ethyl-1H-pyrazol-4-yl]-3,3-dimethylbutanamide

V004-7277 Screening compound: N-[3-(4-chlorophenyl)-5-ethyl-1H-pyrazol-4-yl]-3,3-dimethylbutanamide
V004-7277 Screening compound: N-[3-(4-chlorophenyl)-5-ethyl-1H-pyrazol-4-yl]-3,3-dimethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-7277
N-[3-(4-chlorophenyl)-5-ethyl-1H-pyrazol-4-yl]-3,3-dimethylbutanamide

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

V004-7277

Molecular Formula

C17H22ClN3O (C17 H22 ClN3 O)

Compound Name

N-[3-(4-chlorophenyl)-5-ethyl-1H-pyrazol-4-yl]-3,3-dimethylbutanamide

IUPAC name

N-[3-(4-chlorophenyl)-5-ethyl-1H-pyrazol-4-yl]-33-dimethylbutanamide

SMILES

CCc([nH]nc1-c(cc2)ccc2Cl)c1NC(CC(C)(C)C)=O

InChI

InChI=1S/C17H22ClN3O/c1-5-13-16(19-14(22)10-17(2,3)4)15(21-20-13)11-6-8-12(18)9-7-11/h6-9H,5,10H2,1-4H3,(H,19,22)(H,20,21)

InChI Key

KRRFPRMUJLKVGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14266276

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

319.83

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.039

Distribution Coefficient, logD

4.039

Water Solubility, LogSw

-4.41

Polar Surface Area

46.518

Acid Dissociation Constant (pKa)

11.96

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

References: we are preparing a list of scientific research reports with V004-7277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-7277?
Check Price and Availability of V004-7277, 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 V004-7277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-7277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-7277
  • 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 V004-7277 available by request