D470-1743 Screening compound: (3S,4R)-3-[(2-methoxybenzyl)amino]-4-(phenylsulfonyl)tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

D470-1743 Screening compound: (3S,4R)-3-[(2-methoxybenzyl)amino]-4-(phenylsulfonyl)tetrahydro-1H-1lambda~6~-thiophene-1,1-dione
D470-1743 Screening compound: (3S,4R)-3-[(2-methoxybenzyl)amino]-4-(phenylsulfonyl)tetrahydro-1H-1lambda~6~-thiophene-1,1-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D470-1743
(3S,4R)-3-[(2-methoxybenzyl)amino]-4-(phenylsulfonyl)tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

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

D470-1743

Molecular Formula

C18H21NO5S2 (C18 H21 NO5 S2)

Compound Name

(3S,4R)-3-[(2-methoxybenzyl)amino]-4-(phenylsulfonyl)tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

IUPAC name

(3R4S)-3-(benzenesulfonyl)-4-{[(2-methoxyphenyl)methyl]amino}-1lambda6-thiolane-11-dione

SMILES

COc1c(CN[C@@H](CS(C2)(=O)=O)[C@H]2S(c2ccccc2)(=O)=O)cccc1

InChI

InChI=1S/C18H21NO5S2/c1-24-17-10-6-5-7-14(17)11-19-16-12-25(20,21)13-18(16)26(22,23)15-8-3-2-4-9-15/h2-10,16,18-19H,11-13H2,1H3/t16-,18-/m1/s1

InChI Key

SOLGGAWZHUAAKS-SJLPKXTDSA-N

MDL Number (MFCD)

MFCD10089012

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.091

Distribution Coefficient, logD

1.091

Water Solubility, LogSw

-2.04

Polar Surface Area

77.479

Acid Dissociation Constant (pKa)

18.56

Base Dissociation Constant (pKb)

3.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.30

D470-1743 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D470-1743 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D470-1743?
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What is the minimum amount of D470-1743 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D470-1743
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D470-1743
  • 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 D470-1743 available by request