E570-2295 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(2-methylcyclohexyl)propanamide

E570-2295 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(2-methylcyclohexyl)propanamide
E570-2295 Screening compound: 3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(2-methylcyclohexyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E570-2295
3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(2-methylcyclohexyl)propanamide

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

E570-2295

Molecular Formula

C21H31N3O4S (C21 H31 N3 O4 S)

Compound Name

3-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(2-methylcyclohexyl)propanamide

IUPAC name

3-(1-acetyl-2-methyl-23-dihydro-1H-indole-5-sulfonamido)-N-(2-methylcyclohexyl)propanamide

SMILES

CC(C1)N(C(C)=O)c(cc2)c1cc2S(NCCC(NC1C(C)CCCC1)=O)(=O)=O

InChI

InChI=1S/C21H31N3O4S/c1-14-6-4-5-7-19(14)23-21(26)10-11-22-29(27,28)18-8-9-20-17(13-18)12-15(2)24(20)16(3)25/h8-9,13-15,19,22H,4-7,10-12H2,1-3H3,(H,23,26)

InChI Key

VKKHGDPEEUKONS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14899842

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.641

Distribution Coefficient, logD

2.641

Water Solubility, LogSw

-3.26

Polar Surface Area

81.782

Acid Dissociation Constant (pKa)

11.09

Base Dissociation Constant (pKb)

4.68

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

61.90

E570-2295 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with E570-2295 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E570-2295?
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What is the minimum amount of E570-2295 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E570-2295
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E570-2295
  • 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 E570-2295 available by request