V027-9707 Screening compound: N-[3-({1-[(furan-2-yl)methyl]-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

V027-9707 Screening compound: N-[3-({1-[(furan-2-yl)methyl]-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide
V027-9707 Screening compound: N-[3-({1-[(furan-2-yl)methyl]-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-9707
N-[3-({1-[(furan-2-yl)methyl]-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

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

V027-9707

Molecular Formula

C27H27N3O4S (C27 H27 N3 O4 S)

Compound Name

N-[3-({1-[(furan-2-yl)methyl]-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

IUPAC name

N-[3-({1-[(furan-2-yl)methyl]-4-[(4-methylphenyl)amino]-25-dioxo-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

SMILES

CC(C)CC(Nc1cccc(SC(C(N(Cc2ccco2)C2=O)=O)=C2Nc2ccc(C)cc2)c1)=O

InChI

InChI=1S/C27H27N3O4S/c1-17(2)14-23(31)28-20-6-4-8-22(15-20)35-25-24(29-19-11-9-18(3)10-12-19)26(32)30(27(25)33)16-21-7-5-13-34-21/h4-13,15,17,29H,14,16H2,1-3H3,(H,28,31)

InChI Key

AZBAVCGVJJRXKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497222

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

489.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.082

Distribution Coefficient, logD

5.082

Water Solubility, LogSw

-4.81

Polar Surface Area

69.501

Acid Dissociation Constant (pKa)

10.51

Base Dissociation Constant (pKb)

-2.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with V027-9707 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-9707?
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What is the minimum amount of V027-9707 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-9707
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-9707
  • 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 V027-9707 available by request