V024-9581 Screening compound: ethyl 4-{2-[1-(4-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

V024-9581 Screening compound: ethyl 4-{2-[1-(4-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
V024-9581 Screening compound: ethyl 4-{2-[1-(4-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-9581
ethyl 4-{2-[1-(4-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-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

V024-9581

Molecular Formula

C22H26N2O5 (C22 H26 N2 O5)

Compound Name

ethyl 4-{2-[1-(4-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-{2-[1-(4-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(C(CN(CC=C)C(c(cc2)ccc2OC)=O)=O)c(C)[nH]1)=O

InChI

InChI=1S/C22H26N2O5/c1-6-12-24(21(26)16-8-10-17(28-5)11-9-16)13-18(25)19-14(3)20(23-15(19)4)22(27)29-7-2/h6,8-11,23H,1,7,12-13H2,2-5H3

InChI Key

SAZTVRBSSNPJCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14251906

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.856

Distribution Coefficient, logD

2.856

Water Solubility, LogSw

-3.20

Polar Surface Area

68.954

Acid Dissociation Constant (pKa)

6.10

Base Dissociation Constant (pKb)

-4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with V024-9581 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-9581?
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What is the minimum amount of V024-9581 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-9581
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-9581
  • 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 V024-9581 available by request