8019-0616 Screening compound: 1-[3-(dimethylamino)propyl]-3-(4-fluorobenzenesulfonyl)-4,5-dimethyl-1H-pyrrol-2-amine
Chemical Structure Depiction of ChemDiv screening compound 8019-0616
1-[3-(dimethylamino)propyl]-3-(4-fluorobenzenesulfonyl)-4,5-dimethyl-1H-pyrrol-2-amine
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
8019-0616
Molecular Formula
C17H24FN3O2S (C17 H24 FN3 O2 S)
Compound Name
1-[3-(dimethylamino)propyl]-3-(4-fluorobenzenesulfonyl)-4,5-dimethyl-1H-pyrrol-2-amine
IUPAC name
1-[3-(dimethylamino)propyl]-3-(4-fluorobenzenesulfonyl)-45-dimethyl-1H-pyrrol-2-amine
SMILES
Cc1c(C)n(CCCN(C)C)c(N)c1S(c(cc1)ccc1F)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
353.46
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
1.862
Distribution Coefficient, logD
-0.051
Water Solubility, LogSw
-2.44
Polar Surface Area
54.803
Acid Dissociation Constant (pKa)
19.23
Base Dissociation Constant (pKb)
9.31
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
41.20
8019-0616 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with 8019-0616 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)