8017-5022 Screening compound: 2'-amino-1'-(dimethylamino)-7',7'-dimethyl-2,5'-dioxo-1-propyl-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile

8017-5022 Screening compound: 2'-amino-1'-(dimethylamino)-7',7'-dimethyl-2,5'-dioxo-1-propyl-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
8017-5022 Screening compound: 2'-amino-1'-(dimethylamino)-7',7'-dimethyl-2,5'-dioxo-1-propyl-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-5022
2'-amino-1'-(dimethylamino)-7',7'-dimethyl-2,5'-dioxo-1-propyl-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile

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

8017-5022

Molecular Formula

C24H29N5O2 (C24 H29 N5 O2)

Compound Name

2'-amino-1'-(dimethylamino)-7',7'-dimethyl-2,5'-dioxo-1-propyl-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile

IUPAC name

2'-amino-1'-(dimethylamino)-7'7'-dimethyl-25'-dioxo-1-propyl-125'6'7'8'-hexahydro-1'H-spiro[indole-34'-quinoline]-3'-carbonitrile

SMILES

CCCN(C(C1(C2=C3CC(C)(C)CC2=O)C(C#N)=C(N)N3N(C)C)=O)c2c1cccc2

InChI

InChI=1S/C24H29N5O2/c1-6-11-28-17-10-8-7-9-15(17)24(22(28)31)16(14-25)21(26)29(27(4)5)18-12-23(2,3)13-19(30)20(18)24/h7-10H,6,11-13,26H2,1-5H3/t24-/m1/s1

InChI Key

FIJQGMVXINUIPX-XMMPIXPASA-N

MDL Number (MFCD)

MFCD06017384

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.414

Distribution Coefficient, logD

2.414

Water Solubility, LogSw

-2.75

Polar Surface Area

77.630

Acid Dissociation Constant (pKa)

17.02

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.83

References: we are preparing a list of scientific research reports with 8017-5022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-5022?
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What is the minimum amount of 8017-5022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-5022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-5022
  • 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 8017-5022 available by request