G008-3008 Screening compound: N-[(3-methoxyphenyl)methyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound G008-3008
N-[(3-methoxyphenyl)methyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-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
G008-3008
Molecular Formula
C16H13F3N2O4S2 (C16 H13 F3 N2 O4 S2)
Compound Name
N-[(3-methoxyphenyl)methyl]-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonamide
IUPAC name
N-[(3-methoxyphenyl)methyl]-5-[5-(trifluoromethyl)-12-oxazol-3-yl]thiophene-2-sulfonamide
SMILES
COc1cccc(CNS(c2ccc(-c3noc(C(F)(F)F)c3)s2)(=O)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
418.42
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
4.309
Distribution Coefficient, logD
4.305
Water Solubility, LogSw
-4.44
Polar Surface Area
72.094
Acid Dissociation Constant (pKa)
9.48
Base Dissociation Constant (pKb)
-5.61
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
18.80
G008-3008 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Anticancer Library (62698 compounds)
CNS targets activity set (6557 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Cancer
References: we are preparing a list of scientific research reports with G008-3008 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)