2326-3307 Screening compound: ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

2326-3307 Screening compound: ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2326-3307 Screening compound: ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2326-3307
ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

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

2326-3307

Molecular Formula

C25H26N2O4 (C25 H26 N2 O4)

Compound Name

ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

IUPAC name

ethyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(pyridin-2-yl)-145678-hexahydroquinoline-3-carboxylate

SMILES

CCOC(C(C1c2ncccc2)=C(C)NC(CC(C2)c(cc3)ccc3OC)=C1C2=O)=O

InChI

InChI=1S/C25H26N2O4/c1-4-31-25(29)22-15(2)27-20-13-17(16-8-10-18(30-3)11-9-16)14-21(28)23(20)24(22)19-7-5-6-12-26-19/h5-12,17,24,27H,4,13-14H2,1-3H3

InChI Key

QDOHZHBCRIYWGA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01445599

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.761

Distribution Coefficient, logD

-0.872

Water Solubility, LogSw

-3.95

Polar Surface Area

60.995

Acid Dissociation Constant (pKa)

2.77

Base Dissociation Constant (pKb)

2.68

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

32.00

2326-3307 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2326-3307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2326-3307?
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What is the minimum amount of 2326-3307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2326-3307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2326-3307
  • 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 2326-3307 available by request