D640-0002 Screening compound: N-(4-{[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-4-(trifluoromethyl)benzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound D640-0002
N-(4-{[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-4-(trifluoromethyl)benzene-1-sulfonamide
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
D640-0002
Molecular Formula
C20H20F3N5O2S (C20 H20 F3 N5 O2 S)
Compound Name
N-(4-{[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-4-(trifluoromethyl)benzene-1-sulfonamide
IUPAC name
N-(4-{[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino}phenyl)-4-(trifluoromethyl)benzene-1-sulfonamide
SMILES
Cc1nc(N(C)C)cc(Nc(cc2)ccc2NS(c2ccc(C(F)(F)F)cc2)(=O)=O)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
451.47
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.767
Distribution Coefficient, logD
3.510
Water Solubility, LogSw
-4.59
Polar Surface Area
70.820
Acid Dissociation Constant (pKa)
8.91
Base Dissociation Constant (pKb)
8.63
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.00
D640-0002 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Antifungal Library (16415 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Infections
- Immune system
- animal
- Nervous system
- Agro
- Agro
References: we are preparing a list of scientific research reports with D640-0002 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)