K788-0075 Screening compound: 1-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-3-(3,4-dichlorophenyl)urea

K788-0075 Screening compound: 1-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-3-(3,4-dichlorophenyl)urea
K788-0075 Screening compound: 1-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-3-(3,4-dichlorophenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-0075
1-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-3-(3,4-dichlorophenyl)urea

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

K788-0075

Molecular Formula

C17H17Cl3N2OS (C17 H17 Cl3 N2 OS)

Compound Name

1-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-3-(3,4-dichlorophenyl)urea

IUPAC name

1-{3-[(4-chlorophenyl)sulfanyl]-2-methylpropyl}-3-(34-dichlorophenyl)urea

SMILES

CC(CNC(Nc(cc1)cc(Cl)c1Cl)=O)CSc(cc1)ccc1Cl

InChI

InChI=1S/C17H17Cl3N2OS/c1-11(10-24-14-5-2-12(18)3-6-14)9-21-17(23)22-13-4-7-15(19)16(20)8-13/h2-8,11H,9-10H2,1H3,(H2,21,22,23)/t11-/m0/s1

InChI Key

UPQXGEJYKKMBPA-NSHDSACASA-N

MDL Number (MFCD)

MFCD03834035

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.76

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.798

Distribution Coefficient, logD

6.797

Water Solubility, LogSw

-6.50

Polar Surface Area

33.864

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

-0.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with K788-0075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-0075?
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What is the minimum amount of K788-0075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-0075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-0075
  • 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 K788-0075 available by request