3647-1481 Screening compound: ETHYL 9,10-DIMETHYL-11-SULFANYLIDENE-8-OXA-10,12-DIAZATRICYCLO[7.3.1.0^(2,7)]TRIDECA-2(7),3,5-TRIENE-13-CARBOXYLATE

3647-1481 Screening compound: ETHYL 9,10-DIMETHYL-11-SULFANYLIDENE-8-OXA-10,12-DIAZATRICYCLO[7.3.1.0^(2,7)]TRIDECA-2(7),3,5-TRIENE-13-CARBOXYLATE
3647-1481 Screening compound: ETHYL 9,10-DIMETHYL-11-SULFANYLIDENE-8-OXA-10,12-DIAZATRICYCLO[7.3.1.0^(2,7)]TRIDECA-2(7),3,5-TRIENE-13-CARBOXYLATE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3647-1481
ETHYL 9,10-DIMETHYL-11-SULFANYLIDENE-8-OXA-10,12-DIAZATRICYCLO[7.3.1.0^(2,7)]TRIDECA-2(7),3,5-TRIENE-13-CARBOXYLATE

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

3647-1481

Molecular Formula

C15H18N2O3S (C15 H18 N2 O3 S)

Compound Name

ETHYL 9,10-DIMETHYL-11-SULFANYLIDENE-8-OXA-10,12-DIAZATRICYCLO[7.3.1.0^(2,7)]TRIDECA-2(7),3,5-TRIENE-13-CARBOXYLATE

IUPAC name

n/a

SMILES

CCOC(C(C1NC(N2C)=S)C2(C)Oc2c1cccc2)=O

InChI

InChI=1S/C15H18N2O3S/c1-4-19-13(18)11-12-9-7-5-6-8-10(9)20-15(11,2)17(3)14(21)16-12/h5-8,11-12H,4H2,1-3H3,(H,16,21)/t11?,12?,15-/m0/s1

InChI Key

RCNSZQWRVQZEKU-QOZQQMKHSA-N

MDL Number (MFCD)

MFCD01835612

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.530

Distribution Coefficient, logD

2.530

Water Solubility, LogSw

-2.79

Polar Surface Area

41.915

Acid Dissociation Constant (pKa)

14.52

Base Dissociation Constant (pKb)

-5.50

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

46.70

3647-1481 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3647-1481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3647-1481?
Check Price and Availability of 3647-1481, 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 3647-1481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3647-1481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3647-1481
  • 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 3647-1481 available by request