D215-0597 Screening compound: 1,3-dimethyl-5-({[3-(morpholin-4-yl)propyl]amino}methyl)-2,3-dihydro-1H-1,3-benzodiazol-2-one

D215-0597 Screening compound: 1,3-dimethyl-5-({[3-(morpholin-4-yl)propyl]amino}methyl)-2,3-dihydro-1H-1,3-benzodiazol-2-one
D215-0597 Screening compound: 1,3-dimethyl-5-({[3-(morpholin-4-yl)propyl]amino}methyl)-2,3-dihydro-1H-1,3-benzodiazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D215-0597
1,3-dimethyl-5-({[3-(morpholin-4-yl)propyl]amino}methyl)-2,3-dihydro-1H-1,3-benzodiazol-2-one

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

D215-0597

Molecular Formula

C17H26N4O2 (C17 H26 N4 O2)

Compound Name

1,3-dimethyl-5-({[3-(morpholin-4-yl)propyl]amino}methyl)-2,3-dihydro-1H-1,3-benzodiazol-2-one

IUPAC name

13-dimethyl-5-({[3-(morpholin-4-yl)propyl]amino}methyl)-23-dihydro-1H-13-benzodiazol-2-one

SMILES

CN(c(ccc(CNCCCN1CCOCC1)c1)c1N1C)C1=O

InChI

InChI=1S/C17H26N4O2/c1-19-15-5-4-14(12-16(15)20(2)17(19)22)13-18-6-3-7-21-8-10-23-11-9-21/h4-5,12,18H,3,6-11,13H2,1-2H3

InChI Key

SOQAEBMCSAKTQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07434387

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

318.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.300

Distribution Coefficient, logD

-2.544

Water Solubility, LogSw

-1.87

Polar Surface Area

41.421

Acid Dissociation Constant (pKa)

25.95

Base Dissociation Constant (pKb)

10.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

D215-0597 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D215-0597 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D215-0597?
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What is the minimum amount of D215-0597 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D215-0597
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D215-0597
  • 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 D215-0597 available by request