G434-0065 Screening compound: N-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound G434-0065
N-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-4-(2-oxopyrrolidin-1-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
G434-0065
Molecular Formula
C18H17N3O5S (C18 H17 N3 O5 S)
Compound Name
N-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonamide
IUPAC name
N-(3-methyl-2-oxo-23-dihydro-13-benzoxazol-6-yl)-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonamide
SMILES
CN(c(ccc(NS(c(cc1)ccc1N(CCC1)C1=O)(=O)=O)c1)c1O1)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
387.42
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
1.982
Distribution Coefficient, logD
1.905
Water Solubility, LogSw
-3.03
Polar Surface Area
80.570
Acid Dissociation Constant (pKa)
8.11
Base Dissociation Constant (pKb)
-0.14
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.20
G434-0065 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with G434-0065 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)