C361-1571 Screening compound: N-(3,5-dimethylphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

C361-1571 Screening compound: N-(3,5-dimethylphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide
C361-1571 Screening compound: N-(3,5-dimethylphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C361-1571
N-(3,5-dimethylphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]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

C361-1571

Molecular Formula

C23H28N2O4S (C23 H28 N2 O4 S)

Compound Name

N-(3,5-dimethylphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

IUPAC name

N-(35-dimethylphenyl)-3-[(2-methyl-1-propanoyl-23-dihydro-1H-indol-5-yl)sulfonyl]propanamide

SMILES

CCC(N(C(C)C1)c(cc2)c1cc2S(CCC(Nc1cc(C)cc(C)c1)=O)(=O)=O)=O

InChI

InChI=1S/C23H28N2O4S/c1-5-23(27)25-17(4)13-18-14-20(6-7-21(18)25)30(28,29)9-8-22(26)24-19-11-15(2)10-16(3)12-19/h6-7,10-12,14,17H,5,8-9,13H2,1-4H3,(H,24,26)/t17-/m1/s1

InChI Key

PDPRXNUDWFCWKA-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD14752943

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.252

Distribution Coefficient, logD

3.252

Water Solubility, LogSw

-3.65

Polar Surface Area

66.514

Acid Dissociation Constant (pKa)

12.13

Base Dissociation Constant (pKb)

-1.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

C361-1571 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 C361-1571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C361-1571?
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What is the minimum amount of C361-1571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C361-1571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C361-1571
  • 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 C361-1571 available by request