F294-0632 Screening compound: 2-[benzyl(butyl)amino]-5-(4-methylbenzenesulfonamido)benzoic acid
Chemical Structure Depiction of ChemDiv screening compound F294-0632
2-[benzyl(butyl)amino]-5-(4-methylbenzenesulfonamido)benzoic acid
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
F294-0632
Molecular Formula
C25H28N2O4S (C25 H28 N2 O4 S)
Compound Name
2-[benzyl(butyl)amino]-5-(4-methylbenzenesulfonamido)benzoic acid
IUPAC name
2-[benzyl(butyl)amino]-5-(4-methylbenzenesulfonamido)benzoic acid
SMILES
CCCCN(Cc1ccccc1)c(ccc(NS(c1ccc(C)cc1)(=O)=O)c1)c1C(O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
CF3COOH
Molecular Weight
452.57
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.975
Distribution Coefficient, logD
4.143
Water Solubility, LogSw
-5.28
Polar Surface Area
71.989
Acid Dissociation Constant (pKa)
5.57
Base Dissociation Constant (pKb)
2.72
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
24.00
F294-0632 in Drug Discovery
Included in Screening Libraries
Glucocorticoid receptors Library (4806 compounds)
Included in 1.7M Stock Database
- Cancer
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Endocrine
- Nuclear receptors
- Receptor's ligands
References: we are preparing a list of scientific research reports with F294-0632 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)