4490-1984 Screening compound: 3-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-2-(4-chlorophenyl)-1,3-thiazolidin-4-one
Chemical Structure Depiction of ChemDiv screening compound 4490-1984
3-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-2-(4-chlorophenyl)-1,3-thiazolidin-4-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
4490-1984
Molecular Formula
C20H24ClN7O3S (C20 H24 ClN7 O3 S)
Compound Name
3-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-2-(4-chlorophenyl)-1,3-thiazolidin-4-one
IUPAC name
3-{[46-bis(morpholin-4-yl)-135-triazin-2-yl]amino}-2-(4-chlorophenyl)-13-thiazolidin-4-one
SMILES
O=C(CSC1c(cc2)ccc2Cl)N1Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
477.97
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
3.657
Distribution Coefficient, logD
3.655
Water Solubility, LogSw
-4.40
Polar Surface Area
80.543
Acid Dissociation Constant (pKa)
10.34
Base Dissociation Constant (pKb)
5.03
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
50.00
4490-1984 in Drug Discovery
Included in Screening Libraries
Antiviral Annotated Library (21441 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
PI3K-Targeted Library (17255 compounds)
Selective Target Activity Profiling Library (14702 compounds)
Akt-Targeted Library (14764 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
- Kinases
- Agro
References: we are preparing a list of scientific research reports with 4490-1984 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)