7173-1527 Screening compound: 6-[(2,6-dimethylmorpholino)sulfonyl]benzo[cd]indol-2(1H)-one

7173-1527 Screening compound: 6-[(2,6-dimethylmorpholino)sulfonyl]benzo[cd]indol-2(1H)-one
7173-1527 Screening compound: 6-[(2,6-dimethylmorpholino)sulfonyl]benzo[cd]indol-2(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7173-1527
6-[(2,6-dimethylmorpholino)sulfonyl]benzo[cd]indol-2(1H)-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

7173-1527

Molecular Formula

C17H18N2O4S (C17 H18 N2 O4 S)

Compound Name

6-[(2,6-dimethylmorpholino)sulfonyl]benzo[cd]indol-2(1H)-one

IUPAC name

9-[(26-dimethylmorpholin-4-yl)sulfonyl]-2-azatricyclo[6.3.1.0^{412}]dodeca-1(12)46810-pentaen-3-one

SMILES

CC(C1)OC(C)CN1S(c(c1cccc2c11)ccc1NC2=O)(=O)=O

InChI

InChI=1S/C17H18N2O4S/c1-10-8-19(9-11(2)23-10)24(21,22)15-7-6-14-16-12(15)4-3-5-13(16)17(20)18-14/h3-7,10-11H,8-9H2,1-2H3,(H,18,20)

InChI Key

FPIISAFZSHOORJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06591024

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.931

Distribution Coefficient, logD

1.927

Water Solubility, LogSw

-3.09

Polar Surface Area

63.854

Acid Dissociation Constant (pKa)

9.44

Base Dissociation Constant (pKb)

-6.08

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

35.29

7173-1527 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 7173-1527 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7173-1527?
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What is the minimum amount of 7173-1527 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7173-1527
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7173-1527
  • 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 7173-1527 available by request