E135-0883 Screening compound: 5-(2,5-dimethoxyphenyl)-2-methyl-1,1-dioxo-N~3~-propyl-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide

E135-0883 Screening compound: 5-(2,5-dimethoxyphenyl)-2-methyl-1,1-dioxo-N~3~-propyl-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
E135-0883 Screening compound: 5-(2,5-dimethoxyphenyl)-2-methyl-1,1-dioxo-N~3~-propyl-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E135-0883
5-(2,5-dimethoxyphenyl)-2-methyl-1,1-dioxo-N~3~-propyl-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-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

E135-0883

Molecular Formula

C16H21N3O5S (C16 H21 N3 O5 S)

Compound Name

5-(2,5-dimethoxyphenyl)-2-methyl-1,1-dioxo-N~3~-propyl-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide

IUPAC name

5-(25-dimethoxyphenyl)-2-methyl-11-dioxo-N-propyl-2H-1lambda626-thiadiazine-3-carboxamide

SMILES

CCCNC(C(N1C)=CC(c(cc(cc2)OC)c2OC)=NS1(=O)=O)=O

InChI

InChI=1S/C16H21N3O5S/c1-5-8-17-16(20)14-10-13(18-25(21,22)19(14)2)12-9-11(23-3)6-7-15(12)24-4/h6-7,9-10H,5,8H2,1-4H3,(H,17,20)

InChI Key

KCPZKDBRPAYECH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14840975

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.638

Distribution Coefficient, logD

1.638

Water Solubility, LogSw

-2.79

Polar Surface Area

84.928

Acid Dissociation Constant (pKa)

11.12

Base Dissociation Constant (pKb)

-0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with E135-0883 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E135-0883?
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What is the minimum amount of E135-0883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E135-0883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E135-0883
  • 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 E135-0883 available by request