C047-1210 Screening compound: methyl 4-{3,3,6,6-tetramethyl-10-[2-(morpholin-4-yl)ethyl]-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl}benzoate

C047-1210 Screening compound: methyl 4-{3,3,6,6-tetramethyl-10-[2-(morpholin-4-yl)ethyl]-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl}benzoate
C047-1210 Screening compound: methyl 4-{3,3,6,6-tetramethyl-10-[2-(morpholin-4-yl)ethyl]-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C047-1210
methyl 4-{3,3,6,6-tetramethyl-10-[2-(morpholin-4-yl)ethyl]-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl}benzoate

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

C047-1210

Molecular Formula

C31H40N2O5 (C31 H40 N2 O5)

Compound Name

methyl 4-{3,3,6,6-tetramethyl-10-[2-(morpholin-4-yl)ethyl]-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl}benzoate

IUPAC name

methyl 4-{3366-tetramethyl-10-[2-(morpholin-4-yl)ethyl]-18-dioxo-12345678910-decahydroacridin-9-yl}benzoate

SMILES

CC(C)(C1)CC(N(CCN2CCOCC2)C(CC(C)(C)C2)=C(C3c(cc4)ccc4C(OC)=O)C2=O)=C3C1=O

InChI

InChI=1S/C31H40N2O5/c1-30(2)16-22-27(24(34)18-30)26(20-6-8-21(9-7-20)29(36)37-5)28-23(17-31(3,4)19-25(28)35)33(22)11-10-32-12-14-38-15-13-32/h6-9,26H,10-19H2,1-5H3

InChI Key

GCUPPANHXAOPHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14714016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.67

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.744

Distribution Coefficient, logD

3.706

Water Solubility, LogSw

-4.18

Polar Surface Area

61.758

Acid Dissociation Constant (pKa)

25.12

Base Dissociation Constant (pKb)

6.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.10

C047-1210 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C047-1210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C047-1210?
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What is the minimum amount of C047-1210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C047-1210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C047-1210
  • 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 C047-1210 available by request