D715-2283 Screening compound: N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]-3-fluorobenzamide
Chemical Structure Depiction of ChemDiv screening compound D715-2283
N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]-3-fluorobenzamide
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
D715-2283
Molecular Formula
C22H23FN2O3S (C22 H23 FN2 O3 S)
Compound Name
N-[3-(benzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]-3-fluorobenzamide
IUPAC name
N-[3-(benzenesulfonyl)-45-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]-3-fluorobenzamide
SMILES
CC(C)n(c(C)c1C)c(NC(c2cc(F)ccc2)=O)c1S(c1ccccc1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
414.5
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.069
Distribution Coefficient, logD
3.847
Water Solubility, LogSw
-4.06
Polar Surface Area
55.547
Acid Dissociation Constant (pKa)
7.58
Base Dissociation Constant (pKb)
-1.70
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.70
D715-2283 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Type II Kinase Inhibitors Library (6956 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- Digestive system
- Hemic and lymphatic
- Endocrine
- Others
- GPCR
- Kinases
- Epigenetic
- Receptor's ligands
References: we are preparing a list of scientific research reports with D715-2283 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)