L741-0421 Screening compound: 4-[1-(4-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carbonyl]thiomorpholine
Chemical Structure Depiction of ChemDiv screening compound L741-0421
4-[1-(4-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carbonyl]thiomorpholine
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
L741-0421
Molecular Formula
C18H16FN5OS (C18 H16 FN5 OS)
Compound Name
4-[1-(4-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carbonyl]thiomorpholine
IUPAC name
4-[1-(4-fluorophenyl)-5-(pyridin-4-yl)-1H-123-triazole-4-carbonyl]thiomorpholine
SMILES
O=C(c1c(-c2ccncc2)n(-c(cc2)ccc2F)nn1)N1CCSCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
369.42
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
1.676
Distribution Coefficient, logD
1.676
Water Solubility, LogSw
-1.79
Polar Surface Area
51.916
Acid Dissociation Constant (pKa)
28.22
Base Dissociation Constant (pKb)
3.27
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.20
L741-0421 in Drug Discovery
Included in Screening Libraries
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Cancer
- Endocrine
- Nervous system
- Cardiovascular
- PPI modulators
- Ion Channels
References: we are preparing a list of scientific research reports with L741-0421 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)