8014-7203 Screening compound: N~6~-(3-bromo-4-propoxyphenyl)-3-(3,4-diethoxyphenethyl)-2-[(3,4-diethoxyphenethyl)imino]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide

8014-7203 Screening compound: N~6~-(3-bromo-4-propoxyphenyl)-3-(3,4-diethoxyphenethyl)-2-[(3,4-diethoxyphenethyl)imino]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide
8014-7203 Screening compound: N~6~-(3-bromo-4-propoxyphenyl)-3-(3,4-diethoxyphenethyl)-2-[(3,4-diethoxyphenethyl)imino]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-7203
N~6~-(3-bromo-4-propoxyphenyl)-3-(3,4-diethoxyphenethyl)-2-[(3,4-diethoxyphenethyl)imino]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-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

8014-7203

Molecular Formula

C38H46BrN3O7S (C38 H46 BrN3 O7 S)

Compound Name

N~6~-(3-bromo-4-propoxyphenyl)-3-(3,4-diethoxyphenethyl)-2-[(3,4-diethoxyphenethyl)imino]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide

IUPAC name

(2E)-N-(3-bromo-4-propoxyphenyl)-3-[2-(34-diethoxyphenyl)ethyl]-2-{[2-(34-diethoxyphenyl)ethyl]imino}-4-oxo-34-dihydro-2H-13-thiazine-6-carboxamide

SMILES

CCCOc(ccc(NC(C(S/C(/N1CCc(cc2)cc(OCC)c2OCC)=N/CCc(cc2)cc(OCC)c2OCC)=CC1=O)=O)c1)c1Br

InChI

InChI=1S/C38H46BrN3O7S/c1-6-21-49-30-16-13-28(24-29(30)39)41-37(44)35-25-36(43)42(20-18-27-12-15-32(46-8-3)34(23-27)48-10-5)38(50-35)40-19-17-26-11-14-31(45-7-2)33(22-26)47-9-4/h11-16,22-25H,6-10,17-21H2,1-5H3,(H,41,44)

InChI Key

KORRJIRGXBOVGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03819581

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

768.77

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

20.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

7.145

Distribution Coefficient, logD

7.134

Water Solubility, LogSw

-5.56

Polar Surface Area

84.822

Acid Dissociation Constant (pKa)

9.13

Base Dissociation Constant (pKb)

5.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.47

8014-7203 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 8014-7203 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-7203?
Check Price and Availability of 8014-7203, 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 8014-7203 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-7203
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-7203
  • 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 8014-7203 available by request