V008-1112 Screening compound: methyl 2-({[(Z)-{1-[5-(4-fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]ethylidene}amino]oxy}methyl)benzoate

V008-1112 Screening compound: methyl 2-({[(Z)-{1-[5-(4-fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]ethylidene}amino]oxy}methyl)benzoate
V008-1112 Screening compound: methyl 2-({[(Z)-{1-[5-(4-fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]ethylidene}amino]oxy}methyl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-1112
methyl 2-({[(Z)-{1-[5-(4-fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]ethylidene}amino]oxy}methyl)benzoate

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

V008-1112

Molecular Formula

C28H25FN2O3 (C28 H25 FN2 O3)

Compound Name

methyl 2-({[(Z)-{1-[5-(4-fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]ethylidene}amino]oxy}methyl)benzoate

IUPAC name

methyl 2-({[(Z)-{1-[5-(4-fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]ethylidene}amino]oxy}methyl)benzoate

SMILES

C/C(/c(cc1-c(cc2)ccc2F)c(C)n1-c1ccccc1)=N/OCc(cccc1)c1C(OC)=O

InChI

InChI=1S/C28H25FN2O3/c1-19(30-34-18-22-9-7-8-12-25(22)28(32)33-3)26-17-27(21-13-15-23(29)16-14-21)31(20(26)2)24-10-5-4-6-11-24/h4-17H,18H2,1-3H3

InChI Key

UBVPCZHRXLNXRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19776301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.822

Distribution Coefficient, logD

6.822

Water Solubility, LogSw

-5.71

Polar Surface Area

41.763

Acid Dissociation Constant (pKa)

24.41

Base Dissociation Constant (pKb)

0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with V008-1112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-1112?
Check Price and Availability of V008-1112, 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 V008-1112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-1112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-1112
  • 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 V008-1112 available by request