V029-3358 Screening compound: N-[3-({4-[(2,4-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

V029-3358 Screening compound: N-[3-({4-[(2,4-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide
V029-3358 Screening compound: N-[3-({4-[(2,4-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-3358
N-[3-({4-[(2,4-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-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

V029-3358

Molecular Formula

C27H33N3O6S (C27 H33 N3 O6 S)

Compound Name

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

IUPAC name

N-[3-({4-[(24-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-25-dioxo-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

SMILES

CC(C)CC(Nc1cccc(SC(C(N(CCCOC)C2=O)=O)=C2Nc(ccc(OC)c2)c2OC)c1)=O

InChI

InChI=1S/C27H33N3O6S/c1-17(2)14-23(31)28-18-8-6-9-20(15-18)37-25-24(26(32)30(27(25)33)12-7-13-34-3)29-21-11-10-19(35-4)16-22(21)36-5/h6,8-11,15-17,29H,7,12-14H2,1-5H3,(H,28,31)

InChI Key

RWLFWDOFUBMKJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497344

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

527.64

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.066

Distribution Coefficient, logD

4.013

Water Solubility, LogSw

-4.15

Polar Surface Area

84.821

Acid Dissociation Constant (pKa)

8.29

Base Dissociation Constant (pKb)

4.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

References: we are preparing a list of scientific research reports with V029-3358 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-3358?
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What is the minimum amount of V029-3358 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-3358
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-3358
  • 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 V029-3358 available by request