V026-5512 Screening compound: N-[4-({4-[(4-methoxyphenyl)amino]-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide

V026-5512 Screening compound: N-[4-({4-[(4-methoxyphenyl)amino]-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide
V026-5512 Screening compound: N-[4-({4-[(4-methoxyphenyl)amino]-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-5512
N-[4-({4-[(4-methoxyphenyl)amino]-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide

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

V026-5512

Molecular Formula

C26H29N3O4S (C26 H29 N3 O4 S)

Compound Name

N-[4-({4-[(4-methoxyphenyl)amino]-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide

IUPAC name

N-[4-({4-[(4-methoxyphenyl)amino]-25-dioxo-1-(propan-2-yl)-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide

SMILES

CC(C)N(C(C(Nc(cc1)ccc1OC)=C1Sc(cc2)ccc2NC(C2CCCC2)=O)=O)C1=O

InChI

InChI=1S/C26H29N3O4S/c1-16(2)29-25(31)22(27-18-8-12-20(33-3)13-9-18)23(26(29)32)34-21-14-10-19(11-15-21)28-24(30)17-6-4-5-7-17/h8-17,27H,4-7H2,1-3H3,(H,28,30)

InChI Key

BVGYIBBZEOAQGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497001

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

479.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.529

Distribution Coefficient, logD

4.527

Water Solubility, LogSw

-4.19

Polar Surface Area

69.788

Acid Dissociation Constant (pKa)

9.76

Base Dissociation Constant (pKb)

-1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with V026-5512 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-5512?
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What is the minimum amount of V026-5512 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-5512
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-5512
  • 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 V026-5512 available by request