C348-0331 Screening compound: 1-(3-methoxyphenyl)-3-[(Z)-{[1-methyl-5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}amino]thiourea

C348-0331 Screening compound: 1-(3-methoxyphenyl)-3-[(Z)-{[1-methyl-5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}amino]thiourea
C348-0331 Screening compound: 1-(3-methoxyphenyl)-3-[(Z)-{[1-methyl-5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}amino]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C348-0331
1-(3-methoxyphenyl)-3-[(Z)-{[1-methyl-5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}amino]thiourea

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

C348-0331

Molecular Formula

C23H27N5O3S2 (C23 H27 N5 O3 S2)

Compound Name

1-(3-methoxyphenyl)-3-[(Z)-{[1-methyl-5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}amino]thiourea

IUPAC name

1-(3-methoxyphenyl)-3-[(Z)-{[1-methyl-5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}amino]thiourea

SMILES

Cn1c(ccc(S(N2CCCCC2)(=O)=O)c2)c2c(/C=N\NC(Nc2cc(OC)ccc2)=S)c1

InChI

InChI=1S/C23H27N5O3S2/c1-27-16-17(15-24-26-23(32)25-18-7-6-8-19(13-18)31-2)21-14-20(9-10-22(21)27)33(29,30)28-11-4-3-5-12-28/h6-10,13-16H,3-5,11-12H2,1-2H3,(H2,25,26,32)

InChI Key

HBWGPURDCFVOND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05032416

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.751

Distribution Coefficient, logD

4.751

Water Solubility, LogSw

-4.41

Polar Surface Area

73.100

Acid Dissociation Constant (pKa)

13.53

Base Dissociation Constant (pKb)

1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with C348-0331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C348-0331?
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What is the minimum amount of C348-0331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C348-0331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C348-0331
  • 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 C348-0331 available by request