S762-0090 Screening compound: (8AR)-N4A-[2-(DIMETHYLAMINO)ETHYL]-1-ETHYL-2

S762-0090 Screening compound: (8AR)-N4A-[2-(DIMETHYLAMINO)ETHYL]-1-ETHYL-2
S762-0090 Screening compound: (8AR)-N4A-[2-(DIMETHYLAMINO)ETHYL]-1-ETHYL-2 alternative view

Chemical Structure Depiction of ChemDiv screening compound S762-0090
(8AR)-N4A-[2-(DIMETHYLAMINO)ETHYL]-1-ETHYL-2

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

S762-0090

Molecular Formula

C15H29N3O3S (C15 H29 N3 O3 S)

Compound Name

(8AR)-N4A-[2-(DIMETHYLAMINO)ETHYL]-1-ETHYL-2

IUPAC name

n/a

SMILES

CCN([C@@H](CCCC1)[C@]1(CC1)C(NCCN(C)C)=O)S1(=O)=O

InChI

InChI=1S/C15H29N3O3S/c1-4-18-13-7-5-6-8-15(13,9-12-22(18,20)21)14(19)16-10-11-17(2)3/h13H,4-12H2,1-3H3,(H,16,19)/t13-,15-/m0/s1

InChI Key

KWHNDLOQABZWFW-ZFWWWQNUSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.423

Distribution Coefficient, logD

-1.289

Water Solubility, LogSw

-1.72

Polar Surface Area

60.106

Acid Dissociation Constant (pKa)

12.90

Base Dissociation Constant (pKb)

9.10

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

16.00

S762-0090 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S762-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S762-0090?
Check Price and Availability of S762-0090, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S762-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S762-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S762-0090
  • 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 S762-0090 available by request