G370-0245 Screening compound: N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide

G370-0245 Screening compound: N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
G370-0245 Screening compound: N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G370-0245
N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-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

G370-0245

Molecular Formula

C22H25N3O3S (C22 H25 N3 O3 S)

Compound Name

N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide

IUPAC name

N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-56-dihydro-14-oxathiine-2-carboxamide

SMILES

CN(CCNC(c(cc1)ccc1NC(C1=CSCCO1)=O)=O)Cc1ccccc1

InChI

InChI=1S/C22H25N3O3S/c1-25(15-17-5-3-2-4-6-17)12-11-23-21(26)18-7-9-19(10-8-18)24-22(27)20-16-29-14-13-28-20/h2-10,16H,11-15H2,1H3,(H,23,26)(H,24,27)

InChI Key

MWPMAMUZNKMJMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15004723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.069

Distribution Coefficient, logD

1.699

Water Solubility, LogSw

-2.76

Polar Surface Area

61.307

Acid Dissociation Constant (pKa)

7.74

Base Dissociation Constant (pKb)

7.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G370-0245 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS Targets (44014 compounds)

Immunological Library (6760 compounds)

PD-1/L1 Library (498 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Immune system
  • Cancer
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G370-0245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G370-0245?
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What is the minimum amount of G370-0245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G370-0245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G370-0245
  • 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 G370-0245 available by request