K007-0786 Screening compound: 3-[(Z)-[1-(4-fluorophenyl)ethylidene]amino]-1-phenylthiourea
Chemical Structure Depiction of ChemDiv screening compound K007-0786
3-[(Z)-[1-(4-fluorophenyl)ethylidene]amino]-1-phenylthiourea
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
K007-0786
Molecular Formula
C15H14FN3S (C15 H14 FN3 S)
Compound Name
3-[(Z)-[1-(4-fluorophenyl)ethylidene]amino]-1-phenylthiourea
IUPAC name
3-[(Z)-[1-(4-fluorophenyl)ethylidene]amino]-1-phenylthiourea
SMILES
C/C(/c(cc1)ccc1F)=N/NC(Nc1ccccc1)=S
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
287.36
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
3.942
Distribution Coefficient, logD
3.942
Water Solubility, LogSw
-4.07
Polar Surface Area
30.573
Acid Dissociation Constant (pKa)
12.33
Base Dissociation Constant (pKb)
2.99
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
6.70
K007-0786 in Drug Discovery
Included in Screening Libraries
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Agro
References: we are preparing a list of scientific research reports with K007-0786 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)