C304-1273 Screening compound: N~8~-benzyl-11-ethyl-N~8~,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide

C304-1273 Screening compound: N~8~-benzyl-11-ethyl-N~8~,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
C304-1273 Screening compound: N~8~-benzyl-11-ethyl-N~8~,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C304-1273
N~8~-benzyl-11-ethyl-N~8~,2-dimethyldibenzo[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

C304-1273

Molecular Formula

C25H24N2OS (C25 H24 N2 OS)

Compound Name

N~8~-benzyl-11-ethyl-N~8~,2-dimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide

IUPAC name

N-benzyl-10-ethyl-N13-dimethyl-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)4691214-heptaene-6-carboxamide

SMILES

CCC1=Nc(cc(cc2)C(N(C)Cc3ccccc3)=O)c2Sc2c1cc(C)cc2

InChI

InChI=1S/C25H24N2OS/c1-4-21-20-14-17(2)10-12-23(20)29-24-13-11-19(15-22(24)26-21)25(28)27(3)16-18-8-6-5-7-9-18/h5-15H,4,16H2,1-3H3

InChI Key

FXHJLZOEHPJEHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26964505

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.711

Distribution Coefficient, logD

5.709

Water Solubility, LogSw

-5.36

Polar Surface Area

24.381

Acid Dissociation Constant (pKa)

23.28

Base Dissociation Constant (pKb)

5.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with C304-1273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C304-1273?
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What is the minimum amount of C304-1273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C304-1273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C304-1273
  • 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 C304-1273 available by request