G408-1070 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2-methyl-5-(2-methyl-1,3-oxazol-5-yl)benzene-1-sulfonamide

G408-1070 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2-methyl-5-(2-methyl-1,3-oxazol-5-yl)benzene-1-sulfonamide
G408-1070 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2-methyl-5-(2-methyl-1,3-oxazol-5-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G408-1070
N-{[4-(dimethylamino)phenyl]methyl}-2-methyl-5-(2-methyl-1,3-oxazol-5-yl)benzene-1-sulfonamide

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

G408-1070

Molecular Formula

C20H23N3O3S (C20 H23 N3 O3 S)

Compound Name

N-{[4-(dimethylamino)phenyl]methyl}-2-methyl-5-(2-methyl-1,3-oxazol-5-yl)benzene-1-sulfonamide

IUPAC name

N-{[4-(dimethylamino)phenyl]methyl}-2-methyl-5-(2-methyl-13-oxazol-5-yl)benzene-1-sulfonamide

SMILES

Cc1ncc(-c2cc(S(NCc(cc3)ccc3N(C)C)(=O)=O)c(C)cc2)o1

InChI

InChI=1S/C20H23N3O3S/c1-14-5-8-17(19-13-21-15(2)26-19)11-20(14)27(24,25)22-12-16-6-9-18(10-7-16)23(3)4/h5-11,13,22H,12H2,1-4H3

InChI Key

YGBNJEPZDLAJCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15010084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.857

Distribution Coefficient, logD

3.844

Water Solubility, LogSw

-3.85

Polar Surface Area

61.753

Acid Dissociation Constant (pKa)

9.65

Base Dissociation Constant (pKb)

5.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G408-1070 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G408-1070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G408-1070?
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What is the minimum amount of G408-1070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G408-1070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G408-1070
  • 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 G408-1070 available by request