V008-7195 Screening compound: ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate

V008-7195 Screening compound: ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate
V008-7195 Screening compound: ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-7195
ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(4-methoxyphenyl)-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

V008-7195

Molecular Formula

C25H29N3O4 (C25 H29 N3 O4)

Compound Name

ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate

IUPAC name

ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate

SMILES

CCC(CC)C(Nc1cccc(-c2cc(C(OCC)=O)nn2-c(cc2)ccc2OC)c1)=O

InChI

InChI=1S/C25H29N3O4/c1-5-17(6-2)24(29)26-19-10-8-9-18(15-19)23-16-22(25(30)32-7-3)27-28(23)20-11-13-21(31-4)14-12-20/h8-17H,5-7H2,1-4H3,(H,26,29)

InChI Key

IUJZEGTVSGIGGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10464079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.325

Distribution Coefficient, logD

5.325

Water Solubility, LogSw

-5.33

Polar Surface Area

64.722

Acid Dissociation Constant (pKa)

13.17

Base Dissociation Constant (pKb)

0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

V008-7195 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with V008-7195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-7195?
Check Price and Availability of V008-7195, 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 V008-7195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-7195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-7195
  • 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 V008-7195 available by request