L372-0079 Screening compound: 1-(4-fluorophenyl)-N-(3-methylbutyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

L372-0079 Screening compound: 1-(4-fluorophenyl)-N-(3-methylbutyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
L372-0079 Screening compound: 1-(4-fluorophenyl)-N-(3-methylbutyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L372-0079
1-(4-fluorophenyl)-N-(3-methylbutyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

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

L372-0079

Molecular Formula

C21H23FN2O3 (C21 H23 FN2 O3)

Compound Name

1-(4-fluorophenyl)-N-(3-methylbutyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

IUPAC name

1-(4-fluorophenyl)-N-(3-methylbutyl)-25-dioxo-125678-hexahydroquinoline-3-carboxamide

SMILES

CC(C)CCNC(C1=CC(C(CCC2)=O)=C2N(c(cc2)ccc2F)C1=O)=O

InChI

InChI=1S/C21H23FN2O3/c1-13(2)10-11-23-20(26)17-12-16-18(4-3-5-19(16)25)24(21(17)27)15-8-6-14(22)7-9-15/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,23,26)

InChI Key

RYFPYMVEGJUTNN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15125550

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.513

Distribution Coefficient, logD

2.513

Water Solubility, LogSw

-2.95

Polar Surface Area

53.106

Acid Dissociation Constant (pKa)

10.95

Base Dissociation Constant (pKb)

-3.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

L372-0079 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L372-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L372-0079?
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What is the minimum amount of L372-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L372-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L372-0079
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of L372-0079 available by request