C464-0936 Screening compound: ethyl 1-[4-methyl-2-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamido)pentanoyl]piperidine-4-carboxylate

C464-0936 Screening compound: ethyl 1-[4-methyl-2-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamido)pentanoyl]piperidine-4-carboxylate
C464-0936 Screening compound: ethyl 1-[4-methyl-2-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamido)pentanoyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C464-0936
ethyl 1-[4-methyl-2-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamido)pentanoyl]piperidine-4-carboxylate

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

C464-0936

Molecular Formula

C25H37N3O6S (C25 H37 N3 O6 S)

Compound Name

ethyl 1-[4-methyl-2-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamido)pentanoyl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[4-methyl-2-(1-propanoyl-23-dihydro-1H-indole-5-sulfonamido)pentanoyl]piperidine-4-carboxylate

SMILES

CCC(N(CC1)c(cc2)c1cc2S(NC(CC(C)C)C(N(CC1)CCC1C(OCC)=O)=O)(=O)=O)=O

InChI

InChI=1S/C25H37N3O6S/c1-5-23(29)28-14-11-19-16-20(7-8-22(19)28)35(32,33)26-21(15-17(3)4)24(30)27-12-9-18(10-13-27)25(31)34-6-2/h7-8,16-18,21,26H,5-6,9-15H2,1-4H3/t21-/m0/s1

InChI Key

RNYFNUHRLIJXDE-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14760189

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.65

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.151

Distribution Coefficient, logD

3.151

Water Solubility, LogSw

-3.61

Polar Surface Area

94.937

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.00

C464-0936 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C464-0936 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C464-0936?
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What is the minimum amount of C464-0936 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C464-0936
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C464-0936
  • 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 C464-0936 available by request