V009-3934 Screening compound: 3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-[(pyridin-3-yl)methyl]-3-(thiophen-2-yl)propanamide
Chemical Structure Depiction of ChemDiv screening compound V009-3934
3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-[(pyridin-3-yl)methyl]-3-(thiophen-2-yl)propanamide
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
V009-3934
Molecular Formula
C28H24FN3OS (C28 H24 FN3 OS)
Compound Name
3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-[(pyridin-3-yl)methyl]-3-(thiophen-2-yl)propanamide
IUPAC name
3-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-[(pyridin-3-yl)methyl]-3-(thiophen-2-yl)propanamide
SMILES
O=C(CC(c1cn(Cc(cc2)ccc2F)c2c1cccc2)c1cccs1)NCc1cnccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
469.58
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.578
Distribution Coefficient, logD
4.576
Water Solubility, LogSw
-4.34
Polar Surface Area
36.435
Acid Dissociation Constant (pKa)
12.93
Base Dissociation Constant (pKb)
5.15
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
14.30
V009-3934 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Indole Derivatives (10091 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cyclic compounds
References: we are preparing a list of scientific research reports with V009-3934 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)