L583-0399 Screening compound: N-[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]cyclopentanecarboxamide
Chemical Structure Depiction of ChemDiv screening compound L583-0399
N-[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]cyclopentanecarboxamide
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
L583-0399
Molecular Formula
C19H22FN3O2 (C19 H22 FN3 O2)
Compound Name
N-[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]cyclopentanecarboxamide
IUPAC name
N-[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]cyclopentanecarboxamide
SMILES
O=C(C1CCCC1)Nc1cc2ccc(N3CCOCC3)nc2c(F)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
343.4
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.687
Distribution Coefficient, logD
3.686
Water Solubility, LogSw
-3.95
Polar Surface Area
43.813
Acid Dissociation Constant (pKa)
10.32
Base Dissociation Constant (pKb)
3.94
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
47.40
L583-0399 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with L583-0399 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)