V014-0632 Screening compound: ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(2-methylphenyl)-1H-pyrazole-3-carboxylate

V014-0632 Screening compound: ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(2-methylphenyl)-1H-pyrazole-3-carboxylate
V014-0632 Screening compound: ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(2-methylphenyl)-1H-pyrazole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-0632
ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(2-methylphenyl)-1H-pyrazole-3-carboxylate

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

V014-0632

Molecular Formula

C25H29N3O3 (C25 H29 N3 O3)

Compound Name

ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(2-methylphenyl)-1H-pyrazole-3-carboxylate

IUPAC name

ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(2-methylphenyl)-1H-pyrazole-3-carboxylate

SMILES

CCC(CC)C(Nc1cccc(-c2cc(C(OCC)=O)nn2-c2c(C)cccc2)c1)=O

InChI

InChI=1S/C25H29N3O3/c1-5-18(6-2)24(29)26-20-13-10-12-19(15-20)23-16-21(25(30)31-7-3)27-28(23)22-14-9-8-11-17(22)4/h8-16,18H,5-7H2,1-4H3,(H,26,29)

InChI Key

POGFBOBFUAUFFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19956601

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.728

Distribution Coefficient, logD

5.728

Water Solubility, LogSw

-5.39

Polar Surface Area

56.877

Acid Dissociation Constant (pKa)

13.17

Base Dissociation Constant (pKb)

0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

V014-0632 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Targets:
  • Proteases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V014-0632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-0632?
Check Price and Availability of V014-0632, 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 V014-0632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-0632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-0632
  • 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 V014-0632 available by request