C304-0330 Screening compound: (11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazino]methanone

C304-0330 Screening compound: (11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazino]methanone
C304-0330 Screening compound: (11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound C304-0330
(11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazino]methanone

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

C304-0330

Molecular Formula

C26H24N4O3S (C26 H24 N4 O3 S)

Compound Name

(11-ethyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-nitrophenyl)piperazino]methanone

IUPAC name

10-ethyl-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)4691214-heptaene

SMILES

CCC1=Nc(cc(cc2)C(N(CC3)CCN3c(cc3)ccc3[N+]([O-])=O)=O)c2Sc2c1cccc2

InChI

InChI=1S/C26H24N4O3S/c1-2-22-21-5-3-4-6-24(21)34-25-12-7-18(17-23(25)27-22)26(31)29-15-13-28(14-16-29)19-8-10-20(11-9-19)30(32)33/h3-12,17H,2,13-16H2,1H3

InChI Key

DYNNHQCODJLRAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26964325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.001

Distribution Coefficient, logD

4.999

Water Solubility, LogSw

-4.57

Polar Surface Area

61.521

Acid Dissociation Constant (pKa)

23.28

Base Dissociation Constant (pKb)

4.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with C304-0330 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C304-0330?
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What is the minimum amount of C304-0330 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C304-0330
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C304-0330
  • 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 C304-0330 available by request