D244-0290 Screening compound: 5-chloro-2-[(3-methylphenyl)methanesulfonyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound D244-0290
5-chloro-2-[(3-methylphenyl)methanesulfonyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
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
D244-0290
Molecular Formula
C20H15ClF3N3O3S (C20 H15 ClF3 N3 O3 S)
Compound Name
5-chloro-2-[(3-methylphenyl)methanesulfonyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
IUPAC name
5-chloro-2-[(3-methylphenyl)methanesulfonyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
SMILES
Cc1cccc(CS(c(nc2)nc(C(Nc3c(C(F)(F)F)cccc3)=O)c2Cl)(=O)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
469.87
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.992
Distribution Coefficient, logD
4.968
Water Solubility, LogSw
-4.96
Polar Surface Area
70.810
Acid Dissociation Constant (pKa)
8.65
Base Dissociation Constant (pKb)
-4.18
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
15.00
D244-0290 in Drug Discovery
Included in Screening Libraries
Autophagy-Targeted Library (4564 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with D244-0290 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)