C361-1611 Screening compound: N-(3-chloro-4-methoxyphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

C361-1611 Screening compound: N-(3-chloro-4-methoxyphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide
C361-1611 Screening compound: N-(3-chloro-4-methoxyphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C361-1611
N-(3-chloro-4-methoxyphenyl)-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

C361-1611

Molecular Formula

C22H25ClN2O5S (C22 H25 ClN2 O5 S)

Compound Name

N-(3-chloro-4-methoxyphenyl)-3-[(2-methyl-1-propanoyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

IUPAC name

N-(3-chloro-4-methoxyphenyl)-3-[(2-methyl-1-propanoyl-23-dihydro-1H-indol-5-yl)sulfonyl]propanamide

SMILES

CCC(N(C(C)C1)c(cc2)c1cc2S(CCC(Nc(cc1)cc(Cl)c1OC)=O)(=O)=O)=O

InChI

InChI=1S/C22H25ClN2O5S/c1-4-22(27)25-14(2)11-15-12-17(6-7-19(15)25)31(28,29)10-9-21(26)24-16-5-8-20(30-3)18(23)13-16/h5-8,12-14H,4,9-11H2,1-3H3,(H,24,26)/t14-/m1/s1

InChI Key

ZEFMIJCIHQXHPN-CQSZACIVSA-N

MDL Number (MFCD)

MFCD14752961

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.070

Distribution Coefficient, logD

3.067

Water Solubility, LogSw

-3.49

Polar Surface Area

74.145

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

-1.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

C361-1611 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 C361-1611 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C361-1611?
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What is the minimum amount of C361-1611 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C361-1611
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C361-1611
  • 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 C361-1611 available by request