E783-0111 Screening compound: N-cyclopentyl-1-methyl-4-oxo-1H,4H-chromeno[3,4-d]imidazole-8-sulfonamide

E783-0111 Screening compound: N-cyclopentyl-1-methyl-4-oxo-1H,4H-chromeno[3,4-d]imidazole-8-sulfonamide
E783-0111 Screening compound: N-cyclopentyl-1-methyl-4-oxo-1H,4H-chromeno[3,4-d]imidazole-8-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E783-0111
N-cyclopentyl-1-methyl-4-oxo-1H,4H-chromeno[3,4-d]imidazole-8-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

E783-0111

Molecular Formula

C16H17N3O4S (C16 H17 N3 O4 S)

Compound Name

N-cyclopentyl-1-methyl-4-oxo-1H,4H-chromeno[3,4-d]imidazole-8-sulfonamide

IUPAC name

N-cyclopentyl-1-methyl-4-oxo-1H4H-chromeno[34-d]imidazole-8-sulfonamide

SMILES

Cn1c(-c(cc(cc2)S(NC3CCCC3)(=O)=O)c2OC2=O)c2nc1

InChI

InChI=1S/C16H17N3O4S/c1-19-9-17-14-15(19)12-8-11(6-7-13(12)23-16(14)20)24(21,22)18-10-4-2-3-5-10/h6-10,18H,2-5H2,1H3

InChI Key

KJVLICLCYVHZEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14918377

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.935

Distribution Coefficient, logD

1.935

Water Solubility, LogSw

-3.02

Polar Surface Area

74.976

Acid Dissociation Constant (pKa)

11.16

Base Dissociation Constant (pKb)

1.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

E783-0111 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E783-0111 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E783-0111?
Check Price and Availability of E783-0111, 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 E783-0111 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E783-0111
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E783-0111
  • 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 E783-0111 available by request