G637-3724 Screening compound: 6-chloro-4-[1-({5-[(1E)-2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-2-ethyl-3,4-dihydro-2H-1,4-benzoxazine

G637-3724 Screening compound: 6-chloro-4-[1-({5-[(1E)-2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-2-ethyl-3,4-dihydro-2H-1,4-benzoxazine
G637-3724 Screening compound: 6-chloro-4-[1-({5-[(1E)-2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-2-ethyl-3,4-dihydro-2H-1,4-benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G637-3724
6-chloro-4-[1-({5-[(1E)-2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-2-ethyl-3,4-dihydro-2H-1,4-benzoxazine

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

G637-3724

Molecular Formula

C28H28ClF2N3O5S (C28 H28 ClF2 N3 O5 S)

Compound Name

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

IUPAC name

6-chloro-4-[1-({5-[(1E)-2-(24-difluorophenyl)ethenyl]-3-methyl-12-oxazol-4-yl}sulfonyl)piperidine-4-carbonyl]-2-ethyl-34-dihydro-2H-14-benzoxazine

SMILES

CCC(C1)Oc(ccc(Cl)c2)c2N1C(C(CC1)CCN1S(c1c(/C=C/c(ccc(F)c2)c2F)onc1C)(=O)=O)=O

InChI

InChI=1S/C28H28ClF2N3O5S/c1-3-22-16-34(24-14-20(29)6-9-25(24)38-22)28(35)19-10-12-33(13-11-19)40(36,37)27-17(2)32-39-26(27)8-5-18-4-7-21(30)15-23(18)31/h4-9,14-15,19,22H,3,10-13,16H2,1-2H3/t22-/m1/s1

InChI Key

PUTMBKCOJJMFTN-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD15024784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

592.06

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.192

Distribution Coefficient, logD

5.192

Water Solubility, LogSw

-5.50

Polar Surface Area

76.021

Acid Dissociation Constant (pKa)

21.67

Base Dissociation Constant (pKb)

-1.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

G637-3724 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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 G637-3724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G637-3724?
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What is the minimum amount of G637-3724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G637-3724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G637-3724
  • 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 G637-3724 available by request