C304-1207 Screening compound: 11-ethyl-N~8~-(4-methoxybenzyl)-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide

C304-1207 Screening compound: 11-ethyl-N~8~-(4-methoxybenzyl)-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
C304-1207 Screening compound: 11-ethyl-N~8~-(4-methoxybenzyl)-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C304-1207
11-ethyl-N~8~-(4-methoxybenzyl)-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide

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

C304-1207

Molecular Formula

C25H24N2O2S (C25 H24 N2 O2 S)

Compound Name

11-ethyl-N~8~-(4-methoxybenzyl)-2-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide

IUPAC name

10-ethyl-N-[(4-methoxyphenyl)methyl]-13-methyl-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)4691214-heptaene-6-carboxamide

SMILES

CCC1=Nc(cc(cc2)C(NCc(cc3)ccc3OC)=O)c2Sc2c1cc(C)cc2

InChI

InChI=1S/C25H24N2O2S/c1-4-21-20-13-16(2)5-11-23(20)30-24-12-8-18(14-22(24)27-21)25(28)26-15-17-6-9-19(29-3)10-7-17/h5-14H,4,15H2,1-3H3,(H,26,28)

InChI Key

OHBVHHLRYRTPQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26964491

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.554

Distribution Coefficient, logD

5.554

Water Solubility, LogSw

-5.35

Polar Surface Area

40.188

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

4.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with C304-1207 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C304-1207?
Check Price and Availability of C304-1207, 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 C304-1207 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C304-1207
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C304-1207
  • 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 C304-1207 available by request