D470-1726 Screening compound: (3S,4R)-3-[(3-methoxypropyl)amino]-4-(phenylsulfonyl)tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

D470-1726 Screening compound: (3S,4R)-3-[(3-methoxypropyl)amino]-4-(phenylsulfonyl)tetrahydro-1H-1lambda~6~-thiophene-1,1-dione
D470-1726 Screening compound: (3S,4R)-3-[(3-methoxypropyl)amino]-4-(phenylsulfonyl)tetrahydro-1H-1lambda~6~-thiophene-1,1-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D470-1726
(3S,4R)-3-[(3-methoxypropyl)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

D470-1726

Molecular Formula

C14H21NO5S2 (C14 H21 NO5 S2)

Compound Name

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

IUPAC name

(3R4S)-3-(benzenesulfonyl)-4-[(3-methoxypropyl)amino]-1lambda6-thiolane-11-dione

SMILES

COCCCN[C@@H](CS(C1)(=O)=O)[C@H]1S(c1ccccc1)(=O)=O

InChI

InChI=1S/C14H21NO5S2/c1-20-9-5-8-15-13-10-21(16,17)11-14(13)22(18,19)12-6-3-2-4-7-12/h2-4,6-7,13-15H,5,8-11H2,1H3/t13-,14-/m1/s1

InChI Key

PKNJSDZBSQWCLF-ZIAGYGMSSA-N

MDL Number (MFCD)

MFCD10042931

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.46

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

-0.272

Distribution Coefficient, logD

-0.272

Water Solubility, LogSw

-1.81

Polar Surface Area

78.304

Acid Dissociation Constant (pKa)

18.74

Base Dissociation Constant (pKb)

4.22

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

57.10

D470-1726 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D470-1726 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D470-1726?
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What is the minimum amount of D470-1726 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D470-1726
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D470-1726
  • 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 D470-1726 available by request