V028-1164 Screening compound: methyl 4-{2-[1-cyclopentyl-N-(cyclopropylmethyl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

V028-1164 Screening compound: methyl 4-{2-[1-cyclopentyl-N-(cyclopropylmethyl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
V028-1164 Screening compound: methyl 4-{2-[1-cyclopentyl-N-(cyclopropylmethyl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-1164
methyl 4-{2-[1-cyclopentyl-N-(cyclopropylmethyl)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

V028-1164

Molecular Formula

C20H28N2O4 (C20 H28 N2 O4)

Compound Name

methyl 4-{2-[1-cyclopentyl-N-(cyclopropylmethyl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

methyl 4-{2-[1-cyclopentyl-N-(cyclopropylmethyl)formamido]acetyl}-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

Cc1c(C(OC)=O)[nH]c(C)c1C(CN(CC1CC1)C(C1CCCC1)=O)=O

InChI

InChI=1S/C20H28N2O4/c1-12-17(13(2)21-18(12)20(25)26-3)16(23)11-22(10-14-8-9-14)19(24)15-6-4-5-7-15/h14-15,21H,4-11H2,1-3H3

InChI Key

AAGRPPUEAACURG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19810404

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

360.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.093

Distribution Coefficient, logD

3.093

Water Solubility, LogSw

-3.04

Polar Surface Area

62.661

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

V028-1164 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V028-1164 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-1164?
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What is the minimum amount of V028-1164 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-1164
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-1164
  • 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 V028-1164 available by request