C464-0956 Screening compound: N-[4-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamide

C464-0956 Screening compound: N-[4-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamide
C464-0956 Screening compound: N-[4-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C464-0956
N-[4-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-1-propanoyl-2,3-dihydro-1H-indole-5-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

C464-0956

Molecular Formula

C27H36N4O4S (C27 H36 N4 O4 S)

Compound Name

N-[4-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-1-propanoyl-2,3-dihydro-1H-indole-5-sulfonamide

IUPAC name

N-[4-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-1-propanoyl-23-dihydro-1H-indole-5-sulfonamide

SMILES

CCC(N(CC1)c(cc2)c1cc2S(NC(CC(C)C)C(N(CC1)CCN1c1ccccc1)=O)(=O)=O)=O

InChI

InChI=1S/C27H36N4O4S/c1-4-26(32)31-13-12-21-19-23(10-11-25(21)31)36(34,35)28-24(18-20(2)3)27(33)30-16-14-29(15-17-30)22-8-6-5-7-9-22/h5-11,19-20,24,28H,4,12-18H2,1-3H3/t24-/m0/s1

InChI Key

ULEYPHZKJZYBLU-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD14760195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.67

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.874

Distribution Coefficient, logD

3.874

Water Solubility, LogSw

-3.97

Polar Surface Area

77.444

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

5.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.10

C464-0956 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C464-0956 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C464-0956?
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What is the minimum amount of C464-0956 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C464-0956
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C464-0956
  • 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 C464-0956 available by request