V004-2643 Screening compound: methyl 4-[2-(N-cyclopropyl-2-methylpropanamido)acetyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

V004-2643 Screening compound: methyl 4-[2-(N-cyclopropyl-2-methylpropanamido)acetyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
V004-2643 Screening compound: methyl 4-[2-(N-cyclopropyl-2-methylpropanamido)acetyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-2643
methyl 4-[2-(N-cyclopropyl-2-methylpropanamido)acetyl]-1-ethyl-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

V004-2643

Molecular Formula

C19H28N2O4 (C19 H28 N2 O4)

Compound Name

methyl 4-[2-(N-cyclopropyl-2-methylpropanamido)acetyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

methyl 4-[2-(N-cyclopropyl-2-methylpropanamido)acetyl]-1-ethyl-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCn1c(C(OC)=O)c(C)c(C(CN(C2CC2)C(C(C)C)=O)=O)c1C

InChI

InChI=1S/C19H28N2O4/c1-7-20-13(5)16(12(4)17(20)19(24)25-6)15(22)10-21(14-8-9-14)18(23)11(2)3/h11,14H,7-10H2,1-6H3

InChI Key

PHTDZZAFNYDIEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14258259

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.754

Distribution Coefficient, logD

2.754

Water Solubility, LogSw

-2.69

Polar Surface Area

51.169

Acid Dissociation Constant (pKa)

22.75

Base Dissociation Constant (pKb)

-2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.20

V004-2643 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with V004-2643 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-2643?
Check Price and Availability of V004-2643, 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 V004-2643 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-2643
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-2643
  • 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 V004-2643 available by request