G505-0187 Screening compound: 4-fluoro-N-[1-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound G505-0187
4-fluoro-N-[1-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]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
G505-0187
Molecular Formula
C19H17FN2O4S3 (C19 H17 FN2 O4 S3)
Compound Name
4-fluoro-N-[1-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzene-1-sulfonamide
IUPAC name
4-fluoro-N-[1-(thiophene-2-sulfonyl)-1234-tetrahydroquinolin-6-yl]benzene-1-sulfonamide
SMILES
O=S(c1cccs1)(N(CCC1)c(cc2)c1cc2NS(c(cc1)ccc1F)(=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
452.55
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.343
Distribution Coefficient, logD
3.247
Water Solubility, LogSw
-3.77
Polar Surface Area
73.059
Acid Dissociation Constant (pKa)
8.01
Base Dissociation Constant (pKb)
-7.49
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
15.80
G505-0187 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Agro
References: we are preparing a list of scientific research reports with G505-0187 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)