C884-1648 Screening compound: 2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]butanamide

C884-1648 Screening compound: 2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]butanamide
C884-1648 Screening compound: 2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C884-1648
2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]butanamide

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

C884-1648

Molecular Formula

C23H32N6O2 (C23 H32 N6 O2)

Compound Name

2-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]butanamide

IUPAC name

2-{3-methyl-4-oxo-3H4H5H-pyridazino[45-b]indol-5-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]butanamide

SMILES

CCC(C(NCCCN1CCN(C)CC1)=O)n1c(C(N(C)N=C2)=O)c2c2c1cccc2

InChI

InChI=1S/C23H32N6O2/c1-4-19(22(30)24-10-7-11-28-14-12-26(2)13-15-28)29-20-9-6-5-8-17(20)18-16-25-27(3)23(31)21(18)29/h5-6,8-9,16,19H,4,7,10-15H2,1-3H3,(H,24,30)/t19-/m0/s1

InChI Key

SZVCVXXCSUQHSQ-IBGZPJMESA-N

MDL Number (MFCD)

MFCD26966865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.020

Distribution Coefficient, logD

-0.185

Water Solubility, LogSw

-1.96

Polar Surface Area

61.288

Acid Dissociation Constant (pKa)

15.01

Base Dissociation Constant (pKb)

8.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.20

References: we are preparing a list of scientific research reports with C884-1648 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C884-1648?
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What is the minimum amount of C884-1648 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C884-1648
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C884-1648
  • 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 C884-1648 available by request