0393-0130 Screening compound: 1',3',3'-trimethyl-6-nitro-1',3'-dihydrospiro[chromene-2,2'-indole]

0393-0130 Screening compound: 1',3',3'-trimethyl-6-nitro-1',3'-dihydrospiro[chromene-2,2'-indole]
0393-0130 Screening compound: 1',3',3'-trimethyl-6-nitro-1',3'-dihydrospiro[chromene-2,2'-indole] alternative view

Chemical Structure Depiction of ChemDiv screening compound 0393-0130
1',3',3'-trimethyl-6-nitro-1',3'-dihydrospiro[chromene-2,2'-indole]

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

0393-0130

Molecular Formula

C19H18N2O3 (C19 H18 N2 O3)

Compound Name

1',3',3'-trimethyl-6-nitro-1',3'-dihydrospiro[chromene-2,2'-indole]

IUPAC name

1'3'3'-trimethyl-6-nitro-1'3'-dihydrospiro[chromene-22'-indole]

SMILES

CC1(C)c(cccc2)c2N(C)C1(C=C1)Oc(cc2)c1cc2[N+]([O-])=O

InChI

InChI=1S/C19H18N2O3/c1-18(2)15-6-4-5-7-16(15)20(3)19(18)11-10-13-12-14(21(22)23)8-9-17(13)24-19/h4-12H,1-3H3/t19-/m1/s1

InChI Key

PSXPTGAEJZYNFI-LJQANCHMSA-N

MDL Number (MFCD)

MFCD00059175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.507

Distribution Coefficient, logD

4.507

Water Solubility, LogSw

-4.56

Polar Surface Area

41.814

Acid Dissociation Constant (pKa)

28.59

Base Dissociation Constant (pKb)

-1.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

0393-0130 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0393-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0393-0130?
Check Price and Availability of 0393-0130, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0393-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0393-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0393-0130
  • 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 0393-0130 available by request