G008-3019 Screening compound: 8-({5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophen-2-yl}sulfonyl)-1,4-dioxa-8-azaspiro[4.5]decane
Chemical Structure Depiction of ChemDiv screening compound G008-3019
8-({5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophen-2-yl}sulfonyl)-1,4-dioxa-8-azaspiro[4.5]decane
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
G008-3019
Molecular Formula
C15H15F3N2O5S2 (C15 H15 F3 N2 O5 S2)
Compound Name
8-({5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophen-2-yl}sulfonyl)-1,4-dioxa-8-azaspiro[4.5]decane
IUPAC name
8-({5-[5-(trifluoromethyl)-12-oxazol-3-yl]thiophen-2-yl}sulfonyl)-14-dioxa-8-azaspiro[4.5]decane
SMILES
O=S(c1ccc(-c2noc(C(F)(F)F)c2)s1)(N(CC1)CCC11OCCO1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
424.42
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.074
Distribution Coefficient, logD
3.074
Water Solubility, LogSw
-3.32
Polar Surface Area
68.940
Acid Dissociation Constant (pKa)
27.46
Base Dissociation Constant (pKb)
-6.13
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
53.30
G008-3019 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Akt-Targeted Library (14764 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Others
- Kinases
- Epigenetic
- Agro
References: we are preparing a list of scientific research reports with G008-3019 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)