C388-0714 Screening compound: 1-cycloheptyl-1-[(1-ethyl-1H-indol-3-yl)methyl]-3-(4-methylphenyl)thiourea

C388-0714 Screening compound: 1-cycloheptyl-1-[(1-ethyl-1H-indol-3-yl)methyl]-3-(4-methylphenyl)thiourea
C388-0714 Screening compound: 1-cycloheptyl-1-[(1-ethyl-1H-indol-3-yl)methyl]-3-(4-methylphenyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C388-0714
1-cycloheptyl-1-[(1-ethyl-1H-indol-3-yl)methyl]-3-(4-methylphenyl)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

C388-0714

Molecular Formula

C26H33N3S (C26 H33 N3 S)

Compound Name

1-cycloheptyl-1-[(1-ethyl-1H-indol-3-yl)methyl]-3-(4-methylphenyl)thiourea

IUPAC name

1-cycloheptyl-1-[(1-ethyl-1H-indol-3-yl)methyl]-3-(4-methylphenyl)thiourea

SMILES

CCn1c(cccc2)c2c(CN(C2CCCCCC2)C(Nc2ccc(C)cc2)=S)c1

InChI

InChI=1S/C26H33N3S/c1-3-28-18-21(24-12-8-9-13-25(24)28)19-29(23-10-6-4-5-7-11-23)26(30)27-22-16-14-20(2)15-17-22/h8-9,12-18,23H,3-7,10-11,19H2,1-2H3,(H,27,30)

InChI Key

COVOCZDWHXCYEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26964990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.63

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.161

Distribution Coefficient, logD

7.161

Water Solubility, LogSw

-5.87

Polar Surface Area

11.732

Acid Dissociation Constant (pKa)

15.63

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

C388-0714 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C388-0714 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C388-0714?
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What is the minimum amount of C388-0714 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C388-0714
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C388-0714
  • 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 C388-0714 available by request