S029-2307 Screening compound: 2-(TERT-BUTYLAMINO)-N,N-DIMETHYL-4,5-DIHYDRO-1'H-SPIRO[1,4-BENZODIAZEPINE-3,3'-PYRROLIDINE]-1'-SULFONAMIDE

S029-2307 Screening compound: 2-(TERT-BUTYLAMINO)-N,N-DIMETHYL-4,5-DIHYDRO-1'H-SPIRO[1,4-BENZODIAZEPINE-3,3'-PYRROLIDINE]-1'-SULFONAMIDE
S029-2307 Screening compound: 2-(TERT-BUTYLAMINO)-N,N-DIMETHYL-4,5-DIHYDRO-1'H-SPIRO[1,4-BENZODIAZEPINE-3,3'-PYRROLIDINE]-1'-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound S029-2307
2-(TERT-BUTYLAMINO)-N,N-DIMETHYL-4,5-DIHYDRO-1'H-SPIRO[1,4-BENZODIAZEPINE-3,3'-PYRROLIDINE]-1'-SULFONAMIDE

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

S029-2307

Molecular Formula

C18H29N5O2S (C18 H29 N5 O2 S)

Compound Name

2-(TERT-BUTYLAMINO)-N,N-DIMETHYL-4,5-DIHYDRO-1'H-SPIRO[1,4-BENZODIAZEPINE-3,3'-PYRROLIDINE]-1'-SULFONAMIDE

IUPAC name

n/a

SMILES

CC(C)(C)NC(C(CC1)(CN1S(N(C)C)(=O)=O)NC1)=Nc2c1cccc2

InChI

InChI=1S/C18H29N5O2S/c1-17(2,3)21-16-18(10-11-23(13-18)26(24,25)22(4)5)19-12-14-8-6-7-9-15(14)20-16/h6-9,19H,10-13H2,1-5H3,(H,20,21)/t18-/m0/s1

InChI Key

JZNOPBXWDKJAGY-SFHVURJKSA-N

MDL Number (MFCD)

MFCD29028551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.647

Distribution Coefficient, logD

1.636

Water Solubility, LogSw

-2.36

Polar Surface Area

67.886

Acid Dissociation Constant (pKa)

15.76

Base Dissociation Constant (pKb)

5.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.10

S029-2307 in Drug Discovery

Included in Screening Libraries

Bromodomain Modulators Library (5801 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Spiro Library (21655 compounds)

Anti-HIV1 Library (19540 compounds)

New Agro Library (44492 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with S029-2307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S029-2307?
Check Price and Availability of S029-2307, 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 S029-2307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S029-2307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S029-2307
  • 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 S029-2307 available by request