Y020-6321 Screening compound: 3-(4-fluorophenyl)-11-(4-methylphenyl)-3,4,5,11-tetrahydrodibenzo[b,e][1,4]thiazepin-1(2H)-one
Chemical Structure Depiction of ChemDiv screening compound Y020-6321
3-(4-fluorophenyl)-11-(4-methylphenyl)-3,4,5,11-tetrahydrodibenzo[b,e][1,4]thiazepin-1(2H)-one
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
Y020-6321
Molecular Formula
C26H22FNOS (C26 H22 FNOS)
Compound Name
3-(4-fluorophenyl)-11-(4-methylphenyl)-3,4,5,11-tetrahydrodibenzo[b,e][1,4]thiazepin-1(2H)-one
IUPAC name
14-(4-fluorophenyl)-10-(4-methylphenyl)-9-thia-2-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)46-tetraen-12-one
SMILES
Cc1ccc(C2Sc(cccc3)c3NC(CC(C3)c(cc4)ccc4F)=C2C3=O)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
415.53
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
2
Partition Coefficient, logP
6.712
Distribution Coefficient, logD
6.712
Water Solubility, LogSw
-5.68
Polar Surface Area
24.329
Acid Dissociation Constant (pKa)
10.83
Base Dissociation Constant (pKb)
-1.62
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
19.20
Y020-6321 in Drug Discovery
Included in Screening Libraries
Allosteric Kinases Inhibitors Library (23117 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Kinases
References: we are preparing a list of scientific research reports with Y020-6321 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of Y020-6321, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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)