V007-4216 Screening compound: methyl 1,3,5-trimethyl-4-{2-[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate

V007-4216 Screening compound: methyl 1,3,5-trimethyl-4-{2-[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate
V007-4216 Screening compound: methyl 1,3,5-trimethyl-4-{2-[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-4216
methyl 1,3,5-trimethyl-4-{2-[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-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

V007-4216

Molecular Formula

C20H25NO4 (C20 H25 NO4)

Compound Name

methyl 1,3,5-trimethyl-4-{2-[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate

IUPAC name

methyl 135-trimethyl-4-{2-[2-(propan-2-yl)phenoxy]acetyl}-1H-pyrrole-2-carboxylate

SMILES

CC(C)c(cccc1)c1OCC(c1c(C)n(C)c(C(OC)=O)c1C)=O

InChI

InChI=1S/C20H25NO4/c1-12(2)15-9-7-8-10-17(15)25-11-16(22)18-13(3)19(20(23)24-6)21(5)14(18)4/h7-10,12H,11H2,1-6H3

InChI Key

WCBHLMXUNWQGIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19901277

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.981

Distribution Coefficient, logD

3.981

Water Solubility, LogSw

-4.45

Polar Surface Area

43.782

Acid Dissociation Constant (pKa)

22.63

Base Dissociation Constant (pKb)

-2.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V007-4216 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V007-4216 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-4216?
Check Price and Availability of V007-4216, 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 V007-4216 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-4216
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-4216
  • 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 V007-4216 available by request