M435-1469 Screening compound: N~3~-[4-(diethylamino)-2-methylphenyl]-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide

M435-1469 Screening compound: N~3~-[4-(diethylamino)-2-methylphenyl]-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
M435-1469 Screening compound: N~3~-[4-(diethylamino)-2-methylphenyl]-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M435-1469
N~3~-[4-(diethylamino)-2-methylphenyl]-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-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

M435-1469

Molecular Formula

C24H29N3O3S (C24 H29 N3 O3 S)

Compound Name

N~3~-[4-(diethylamino)-2-methylphenyl]-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide

IUPAC name

N-[4-(diethylamino)-2-methylphenyl]-3-hydroxy-11-methyl-5-oxo-8-thia-6-azatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)3-triene-4-carboxamide

SMILES

CCN(CC)c(cc1)cc(C)c1NC(C(C(Nc1c2c(CCC(C)C3)c3s1)=O)=C2O)=O

InChI

InChI=1S/C24H29N3O3S/c1-5-27(6-2)15-8-10-17(14(4)12-15)25-22(29)20-21(28)19-16-9-7-13(3)11-18(16)31-24(19)26-23(20)30/h8,10,12-13H,5-7,9,11H2,1-4H3,(H,25,29)(H2,26,28,30)/t13-/m1/s1

InChI Key

DMJOXSSKROXHIK-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD27541408

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.361

Distribution Coefficient, logD

0.680

Water Solubility, LogSw

-4.41

Polar Surface Area

65.140

Acid Dissociation Constant (pKa)

3.72

Base Dissociation Constant (pKb)

9.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

M435-1469 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with M435-1469 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M435-1469?
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What is the minimum amount of M435-1469 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M435-1469
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M435-1469
  • 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 M435-1469 available by request