V027-4185 Screening compound: N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide

V027-4185 Screening compound: N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide
V027-4185 Screening compound: N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-4185
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide

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

V027-4185

Molecular Formula

C27H24FN3O5 (C27 H24 FN3 O5)

Compound Name

N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide

IUPAC name

N-{2-[5-(2H-13-benzodioxol-5-yl)-3-(4-methoxyphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3-fluoro-N-methylbenzamide

SMILES

CN(CC(N(C(C1)c(cc2)cc3c2OCO3)N=C1c(cc1)ccc1OC)=O)C(c1cccc(F)c1)=O

InChI

InChI=1S/C27H24FN3O5/c1-30(27(33)19-4-3-5-20(28)12-19)15-26(32)31-23(18-8-11-24-25(13-18)36-16-35-24)14-22(29-31)17-6-9-21(34-2)10-7-17/h3-13,23H,14-16H2,1-2H3/t23-/m0/s1

InChI Key

YRBZBRMTZLHISG-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19800427

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

489.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.078

Distribution Coefficient, logD

4.078

Water Solubility, LogSw

-4.41

Polar Surface Area

67.668

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

2.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

V027-4185 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Immunological Library (6760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Immune system

References: we are preparing a list of scientific research reports with V027-4185 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-4185?
Check Price and Availability of V027-4185, 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 V027-4185 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-4185
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-4185
  • 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 V027-4185 available by request