C200-1264 Screening compound: 10-allyl-6-methoxy-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione

C200-1264 Screening compound: 10-allyl-6-methoxy-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione
C200-1264 Screening compound: 10-allyl-6-methoxy-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-1264
10-allyl-6-methoxy-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione

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

C200-1264

Molecular Formula

C15H18N2O2S (C15 H18 N2 O2 S)

Compound Name

10-allyl-6-methoxy-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-11-thione

IUPAC name

6-methoxy-9-methyl-10-(prop-2-en-1-yl)-8-oxa-1012-diazatricyclo[7.3.1.0^{27}]trideca-246-triene-11-thione

SMILES

CC(CC1N2)(N(CC=C)C2=S)Oc2c1cccc2OC

InChI

InChI=1S/C15H18N2O2S/c1-4-8-17-14(20)16-11-9-15(17,2)19-13-10(11)6-5-7-12(13)18-3/h4-7,11H,1,8-9H2,2-3H3,(H,16,20)

InChI Key

WAVQDXUGWRUHRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05027153

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.877

Distribution Coefficient, logD

2.877

Water Solubility, LogSw

-3.37

Polar Surface Area

28.091

Acid Dissociation Constant (pKa)

15.46

Base Dissociation Constant (pKb)

-2.33

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with C200-1264 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-1264?
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What is the minimum amount of C200-1264 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-1264
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-1264
  • 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 C200-1264 available by request