G943-0270 Screening compound: N~1~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-3-nitrobenzamide

G943-0270 Screening compound: N~1~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-3-nitrobenzamide
G943-0270 Screening compound: N~1~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G943-0270
N~1~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-3-nitrobenzamide

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

G943-0270

Molecular Formula

C22H17N3O4S (C22 H17 N3 O4 S)

Compound Name

N~1~-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-3-nitrobenzamide

IUPAC name

N-{9-ethyl-10-oxo-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3571214-hexaen-5-yl}-3-nitrobenzamide

SMILES

CCN(c(ccc(NC(c1cc([N+]([O-])=O)ccc1)=O)c1)c1Sc1c2cccc1)C2=O

InChI

InChI=1S/C22H17N3O4S/c1-2-24-18-11-10-15(23-21(26)14-6-5-7-16(12-14)25(28)29)13-20(18)30-19-9-4-3-8-17(19)22(24)27/h3-13H,2H2,1H3,(H,23,26)

InChI Key

AVAQRCDXDKJULJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27168925

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.913

Distribution Coefficient, logD

4.913

Water Solubility, LogSw

-4.56

Polar Surface Area

71.870

Acid Dissociation Constant (pKa)

10.71

Base Dissociation Constant (pKb)

-2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

G943-0270 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G943-0270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G943-0270?
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What is the minimum amount of G943-0270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G943-0270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G943-0270
  • 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 G943-0270 available by request