G637-1071 Screening compound: 2-ethyl-4-[1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-3,4-dihydro-2H-1,4-benzothiazine

G637-1071 Screening compound: 2-ethyl-4-[1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-3,4-dihydro-2H-1,4-benzothiazine
G637-1071 Screening compound: 2-ethyl-4-[1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-3,4-dihydro-2H-1,4-benzothiazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G637-1071
2-ethyl-4-[1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-3,4-dihydro-2H-1,4-benzothiazine

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

G637-1071

Molecular Formula

C28H30FN3O4S2 (C28 H30 FN3 O4 S2)

Compound Name

2-ethyl-4-[1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-3,4-dihydro-2H-1,4-benzothiazine

IUPAC name

2-ethyl-4-[1-({5-[(1E)-2-(2-fluorophenyl)ethenyl]-3-methyl-12-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-34-dihydro-2H-14-benzothiazine

SMILES

CCC(C1)Sc(cccc2)c2N1C(C(CC1)CCN1S(c1c(/C=C/c(cccc2)c2F)onc1C)(=O)=O)=O

InChI

InChI=1S/C28H30FN3O4S2/c1-3-22-18-32(24-10-6-7-11-26(24)37-22)28(33)21-14-16-31(17-15-21)38(34,35)27-19(2)30-36-25(27)13-12-20-8-4-5-9-23(20)29/h4-13,21-22H,3,14-18H2,1-2H3/t22-/m1/s1

InChI Key

PBSAPGSHOVNCII-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD15024436

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

555.69

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.318

Distribution Coefficient, logD

5.318

Water Solubility, LogSw

-5.19

Polar Surface Area

68.711

Acid Dissociation Constant (pKa)

22.05

Base Dissociation Constant (pKb)

-1.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

G637-1071 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G637-1071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G637-1071?
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What is the minimum amount of G637-1071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G637-1071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G637-1071
  • 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 G637-1071 available by request