C304-3810 Screening compound: (11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-methoxyphenyl)piperazino]methanone

C304-3810 Screening compound: (11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-methoxyphenyl)piperazino]methanone
C304-3810 Screening compound: (11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-methoxyphenyl)piperazino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound C304-3810
(11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-methoxyphenyl)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

C304-3810

Molecular Formula

C28H29N3O2S (C28 H29 N3 O2 S)

Compound Name

(11-ethyl-2-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-methoxyphenyl)piperazino]methanone

IUPAC name

10-ethyl-6-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-13-methyl-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)ccc3OC)=O)c2Sc2c1cc(C)cc2

InChI

InChI=1S/C28H29N3O2S/c1-4-24-23-17-19(2)5-11-26(23)34-27-12-6-20(18-25(27)29-24)28(32)31-15-13-30(14-16-31)21-7-9-22(33-3)10-8-21/h5-12,17-18H,4,13-16H2,1-3H3

InChI Key

FLXOMUCUKWXCGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26964612

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.642

Distribution Coefficient, logD

5.640

Water Solubility, LogSw

-5.38

Polar Surface Area

35.683

Acid Dissociation Constant (pKa)

23.28

Base Dissociation Constant (pKb)

5.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

C304-3810 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with C304-3810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C304-3810?
Check Price and Availability of C304-3810, 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 C304-3810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C304-3810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C304-3810
  • 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 C304-3810 available by request