C388-0699 Screening compound: 3-(butan-2-yl)-1-(4-ethoxyphenyl)-3-[(1-ethyl-1H-indol-3-yl)methyl]thiourea

C388-0699 Screening compound: 3-(butan-2-yl)-1-(4-ethoxyphenyl)-3-[(1-ethyl-1H-indol-3-yl)methyl]thiourea
C388-0699 Screening compound: 3-(butan-2-yl)-1-(4-ethoxyphenyl)-3-[(1-ethyl-1H-indol-3-yl)methyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C388-0699
3-(butan-2-yl)-1-(4-ethoxyphenyl)-3-[(1-ethyl-1H-indol-3-yl)methyl]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

C388-0699

Molecular Formula

C24H31N3OS (C24 H31 N3 OS)

Compound Name

3-(butan-2-yl)-1-(4-ethoxyphenyl)-3-[(1-ethyl-1H-indol-3-yl)methyl]thiourea

IUPAC name

3-(butan-2-yl)-1-(4-ethoxyphenyl)-3-[(1-ethyl-1H-indol-3-yl)methyl]thiourea

SMILES

CCC(C)N(Cc1cn(CC)c2c1cccc2)C(Nc(cc1)ccc1OCC)=S

InChI

InChI=1S/C24H31N3OS/c1-5-18(4)27(24(29)25-20-12-14-21(15-13-20)28-7-3)17-19-16-26(6-2)23-11-9-8-10-22(19)23/h8-16,18H,5-7,17H2,1-4H3,(H,25,29)/t18-/m0/s1

InChI Key

OHUDKVGAZKWACB-SFHVURJKSA-N

MDL Number (MFCD)

MFCD26964981

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.6

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.054

Distribution Coefficient, logD

6.054

Water Solubility, LogSw

-5.72

Polar Surface Area

18.880

Acid Dissociation Constant (pKa)

15.43

Base Dissociation Constant (pKb)

4.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with C388-0699 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C388-0699?
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What is the minimum amount of C388-0699 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C388-0699
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C388-0699
  • 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 C388-0699 available by request