SA63-1040 Screening compound: N~1~-{2-[9-(3-methoxy-2-methylbenzoyl)-1-oxa-9-azaspiro[5.5]undec-4-yl]ethyl}acetamide

SA63-1040 Screening compound: N~1~-{2-[9-(3-methoxy-2-methylbenzoyl)-1-oxa-9-azaspiro[5.5]undec-4-yl]ethyl}acetamide
SA63-1040 Screening compound: N~1~-{2-[9-(3-methoxy-2-methylbenzoyl)-1-oxa-9-azaspiro[5.5]undec-4-yl]ethyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA63-1040
N~1~-{2-[9-(3-methoxy-2-methylbenzoyl)-1-oxa-9-azaspiro[5.5]undec-4-yl]ethyl}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

SA63-1040

Molecular Formula

C22H32N2O4 (C22 H32 N2 O4)

Compound Name

N~1~-{2-[9-(3-methoxy-2-methylbenzoyl)-1-oxa-9-azaspiro[5.5]undec-4-yl]ethyl}acetamide

IUPAC name

N-{2-[9-(3-methoxy-2-methylbenzoyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]ethyl}acetamide

SMILES

CC(NCCC1CC(CC2)(CCN2C(c2c(C)c(OC)ccc2)=O)OCC1)=O

InChI

InChI=1S/C22H32N2O4/c1-16-19(5-4-6-20(16)27-3)21(26)24-12-9-22(10-13-24)15-18(8-14-28-22)7-11-23-17(2)25/h4-6,18H,7-15H2,1-3H3,(H,23,25)/t18-/m1/s1

InChI Key

OGDZFTOYRNPOHF-GOSISDBHSA-N

MDL Number (MFCD)

MFCD32238811

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.905

Distribution Coefficient, logD

1.905

Water Solubility, LogSw

-2.59

Polar Surface Area

55.545

Acid Dissociation Constant (pKa)

14.65

Base Dissociation Constant (pKb)

0.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.64

References: we are preparing a list of scientific research reports with SA63-1040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA63-1040?
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What is the minimum amount of SA63-1040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA63-1040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA63-1040
  • 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 SA63-1040 available by request