6214-0671 Screening compound: N~1~-[4-(dimethylamino)benzyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4,5-trimethoxybenzamide

6214-0671 Screening compound: N~1~-[4-(dimethylamino)benzyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4,5-trimethoxybenzamide
6214-0671 Screening compound: N~1~-[4-(dimethylamino)benzyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6214-0671
N~1~-[4-(dimethylamino)benzyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4,5-trimethoxybenzamide

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

6214-0671

Molecular Formula

C23H30N2O6S (C23 H30 N2 O6 S)

Compound Name

N~1~-[4-(dimethylamino)benzyl]-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4,5-trimethoxybenzamide

IUPAC name

N-{[4-(dimethylamino)phenyl]methyl}-N-(11-dioxo-1lambda6-thiolan-3-yl)-345-trimethoxybenzamide

SMILES

CN(C)c1ccc(CN(C(CC2)CS2(=O)=O)C(c(cc2OC)cc(OC)c2OC)=O)cc1

InChI

InChI=1S/C23H30N2O6S/c1-24(2)18-8-6-16(7-9-18)14-25(19-10-11-32(27,28)15-19)23(26)17-12-20(29-3)22(31-5)21(13-17)30-4/h6-9,12-13,19H,10-11,14-15H2,1-5H3/t19-/m1/s1

InChI Key

RGRIZZNPKBFILA-LJQANCHMSA-N

MDL Number (MFCD)

MFCD04021798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.764

Distribution Coefficient, logD

1.749

Water Solubility, LogSw

-2.64

Polar Surface Area

69.642

Acid Dissociation Constant (pKa)

20.25

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

6214-0671 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 6214-0671 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6214-0671?
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What is the minimum amount of 6214-0671 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6214-0671
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6214-0671
  • 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 6214-0671 available by request