V029-2745 Screening compound: methyl 4-(2-{N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}acetyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

V029-2745 Screening compound: methyl 4-(2-{N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}acetyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
V029-2745 Screening compound: methyl 4-(2-{N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}acetyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-2745
methyl 4-(2-{N-[(furan-2-yl)methyl]-1-(thiophen-2-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

V029-2745

Molecular Formula

C20H20N2O5S (C20 H20 N2 O5 S)

Compound Name

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

IUPAC name

methyl 4-(2-{N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}acetyl)-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

Cc1c(C(OC)=O)[nH]c(C)c1C(CN(Cc1ccco1)C(c1cccs1)=O)=O

InChI

InChI=1S/C20H20N2O5S/c1-12-17(13(2)21-18(12)20(25)26-3)15(23)11-22(10-14-6-4-8-27-14)19(24)16-7-5-9-28-16/h4-9,21H,10-11H2,1-3H3

InChI Key

QEWUKQWORHFYJW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14253448

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

400.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.009

Distribution Coefficient, logD

3.009

Water Solubility, LogSw

-3.27

Polar Surface Area

70.347

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

-4.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V029-2745 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-2745?
Check Price and Availability of V029-2745, 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 V029-2745 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-2745
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-2745
  • 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 V029-2745 available by request