C348-0269 Screening compound: 3-[(E)-({5-[cyclohexyl(methyl)sulfamoyl]-1H-indol-3-yl}methylidene)amino]-1-(2,3-dimethylphenyl)thiourea

C348-0269 Screening compound: 3-[(E)-({5-[cyclohexyl(methyl)sulfamoyl]-1H-indol-3-yl}methylidene)amino]-1-(2,3-dimethylphenyl)thiourea
C348-0269 Screening compound: 3-[(E)-({5-[cyclohexyl(methyl)sulfamoyl]-1H-indol-3-yl}methylidene)amino]-1-(2,3-dimethylphenyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C348-0269
3-[(E)-({5-[cyclohexyl(methyl)sulfamoyl]-1H-indol-3-yl}methylidene)amino]-1-(2,3-dimethylphenyl)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

C348-0269

Molecular Formula

C25H31N5O2S2 (C25 H31 N5 O2 S2)

Compound Name

3-[(E)-({5-[cyclohexyl(methyl)sulfamoyl]-1H-indol-3-yl}methylidene)amino]-1-(2,3-dimethylphenyl)thiourea

IUPAC name

3-[(E)-({5-[cyclohexyl(methyl)sulfamoyl]-1H-indol-3-yl}methylidene)amino]-1-(23-dimethylphenyl)thiourea

SMILES

Cc1cccc(NC(N/N=C/c2c[nH]c(cc3)c2cc3S(N(C)C2CCCCC2)(=O)=O)=S)c1C

InChI

InChI=1S/C25H31N5O2S2/c1-17-8-7-11-23(18(17)2)28-25(33)29-27-16-19-15-26-24-13-12-21(14-22(19)24)34(31,32)30(3)20-9-5-4-6-10-20/h7-8,11-16,20,26H,4-6,9-10H2,1-3H3,(H2,28,29,33)

InChI Key

MMZVLZAQXMLRTK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14749990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.69

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.563

Distribution Coefficient, logD

6.563

Water Solubility, LogSw

-5.78

Polar Surface Area

73.113

Acid Dissociation Constant (pKa)

12.84

Base Dissociation Constant (pKb)

1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

C348-0269 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 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 C348-0269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C348-0269?
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What is the minimum amount of C348-0269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C348-0269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C348-0269
  • 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 C348-0269 available by request