L489-1987 Screening compound: 2-{6,8-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

L489-1987 Screening compound: 2-{6,8-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
L489-1987 Screening compound: 2-{6,8-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L489-1987
2-{6,8-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

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

L489-1987

Molecular Formula

C24H27N3O2S (C24 H27 N3 O2 S)

Compound Name

2-{6,8-dimethyl-10-oxo-1H,2H,3H,4H,5H,10H-benzo[b]1,6-naphthyridin-2-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

IUPAC name

2-{68-dimethyl-10-oxo-1H2H3H4H5H10H-benzo[b]16-naphthyridin-2-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

SMILES

Cc(cc1C)cc2c1NC(CCN(CC(NCc(cc1)ccc1SC)=O)C1)=C1C2=O

InChI

InChI=1S/C24H27N3O2S/c1-15-10-16(2)23-19(11-15)24(29)20-13-27(9-8-21(20)26-23)14-22(28)25-12-17-4-6-18(30-3)7-5-17/h4-7,10-11H,8-9,12-14H2,1-3H3,(H,25,28)(H,26,29)

InChI Key

XUVZWZKAWJQFPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27457740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.114

Distribution Coefficient, logD

4.065

Water Solubility, LogSw

-4.11

Polar Surface Area

50.133

Acid Dissociation Constant (pKa)

8.32

Base Dissociation Constant (pKb)

2.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L489-1987 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L489-1987 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L489-1987?
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What is the minimum amount of L489-1987 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L489-1987
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L489-1987
  • 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 L489-1987 available by request