G856-9901 Screening compound: 2-({5-[(tert-butylcarbamoyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide
Chemical Structure Depiction of ChemDiv screening compound G856-9901
2-({5-[(tert-butylcarbamoyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide
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
G856-9901
Molecular Formula
C12H19N5O2S2 (C12 H19 N5 O2 S2)
Compound Name
2-({5-[(tert-butylcarbamoyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide
IUPAC name
2-({5-[(tert-butylcarbamoyl)amino]-134-thiadiazol-2-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide
SMILES
CC(C)(C)NC(Nc1nnc(SCC(NCC=C)=O)s1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
329.45
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.180
Distribution Coefficient, logD
2.180
Water Solubility, LogSw
-2.50
Polar Surface Area
80.178
Acid Dissociation Constant (pKa)
11.86
Base Dissociation Constant (pKb)
3.53
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
G856-9901 in Drug Discovery
Included in Screening Libraries
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 G856-9901 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)