C227-0212 Screening compound: 4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxobutanamide

C227-0212 Screening compound: 4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxobutanamide
C227-0212 Screening compound: 4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxobutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C227-0212
4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxobutanamide

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

C227-0212

Molecular Formula

C26H36N4O2 (C26 H36 N4 O2)

Compound Name

4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxobutanamide

IUPAC name

4-(azepan-1-yl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-4-oxobutanamide

SMILES

CC(CC1)CCN1c1cc(C)c(cc(cc2)NC(CCC(N3CCCCCC3)=O)=O)c2n1

InChI

InChI=1S/C26H36N4O2/c1-19-11-15-29(16-12-19)24-17-20(2)22-18-21(7-8-23(22)28-24)27-25(31)9-10-26(32)30-13-5-3-4-6-14-30/h7-8,17-19H,3-6,9-16H2,1-2H3,(H,27,31)

InChI Key

XURBUTXSQOINKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14733582

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.906

Distribution Coefficient, logD

4.906

Water Solubility, LogSw

-4.65

Polar Surface Area

51.086

Acid Dissociation Constant (pKa)

11.10

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.70

References: we are preparing a list of scientific research reports with C227-0212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C227-0212?
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What is the minimum amount of C227-0212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C227-0212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C227-0212
  • 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 C227-0212 available by request