E867-0248 Screening compound: N-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

E867-0248 Screening compound: N-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide
E867-0248 Screening compound: N-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E867-0248
N-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-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

E867-0248

Molecular Formula

C23H23N7O2S (C23 H23 N7 O2 S)

Compound Name

N-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

IUPAC name

N-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-1H2H3H-pyrido[23-b][14]thiazine-1-carboxamide

SMILES

O=C(c(cc1)ccc1NC(N1c2cccnc2SCC1)=O)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C23H23N7O2S/c31-21(28-11-13-29(14-12-28)22-25-9-2-10-26-22)17-4-6-18(7-5-17)27-23(32)30-15-16-33-20-19(30)3-1-8-24-20/h1-10H,11-16H2,(H,27,32)

InChI Key

PBNWSIJDKRIURV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14924652

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.261

Distribution Coefficient, logD

2.261

Water Solubility, LogSw

-2.80

Polar Surface Area

73.695

Acid Dissociation Constant (pKa)

11.83

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with E867-0248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E867-0248?
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What is the minimum amount of E867-0248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E867-0248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E867-0248
  • 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 E867-0248 available by request