D073-0363 Screening compound: 4-fluoro-N-[1-methyl-2-(1-pyrrolidinylmethyl)-1H-1,3-benzimidazol-5-yl]-1-benzenesulfonamide
Chemical Structure Depiction of ChemDiv screening compound D073-0363
4-fluoro-N-[1-methyl-2-(1-pyrrolidinylmethyl)-1H-1,3-benzimidazol-5-yl]-1-benzenesulfonamide
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
D073-0363
Molecular Formula
C19H21FN4O2S (C19 H21 FN4 O2 S)
Compound Name
4-fluoro-N-[1-methyl-2-(1-pyrrolidinylmethyl)-1H-1,3-benzimidazol-5-yl]-1-benzenesulfonamide
IUPAC name
4-fluoro-N-{1-methyl-2-[(pyrrolidin-1-yl)methyl]-1H-13-benzodiazol-5-yl}benzene-1-sulfonamide
SMILES
Cn1c(ccc(NS(c(cc2)ccc2F)(=O)=O)c2)c2nc1CN1CCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
388.47
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.865
Distribution Coefficient, logD
2.386
Water Solubility, LogSw
-3.43
Polar Surface Area
56.973
Acid Dissociation Constant (pKa)
8.16
Base Dissociation Constant (pKb)
7.70
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
31.58
D073-0363 in Drug Discovery
Included in Screening Libraries
Human GPCR Annotated Library (5539 compounds)
Neurotransmitter Transporter Inhibitors Library (11024 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Nervous system
- GPCR
- Ion Channels
- Agro
References: we are preparing a list of scientific research reports with D073-0363 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)