Y200-6226 Screening compound: propan-2-yl 5-carbamoyl-4-methyl-2-[2-(pyrrolidin-1-yl)acetamido]thiophene-3-carboxylate
Chemical Structure Depiction of ChemDiv screening compound Y200-6226
propan-2-yl 5-carbamoyl-4-methyl-2-[2-(pyrrolidin-1-yl)acetamido]thiophene-3-carboxylate
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
Y200-6226
Molecular Formula
C16H23N3O4S (C16 H23 N3 O4 S)
Compound Name
propan-2-yl 5-carbamoyl-4-methyl-2-[2-(pyrrolidin-1-yl)acetamido]thiophene-3-carboxylate
IUPAC name
propan-2-yl 5-carbamoyl-4-methyl-2-[2-(pyrrolidin-1-yl)acetamido]thiophene-3-carboxylate
SMILES
CC(C)OC(c1c(NC(CN2CCCC2)=O)sc(C(N)=O)c1C)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
353.44
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.864
Distribution Coefficient, logD
-1.249
Water Solubility, LogSw
-2.55
Polar Surface Area
81.772
Acid Dissociation Constant (pKa)
3.44
Base Dissociation Constant (pKb)
7.44
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
56.30
Y200-6226 in Drug Discovery
Included in Screening Libraries
Neurotransmitter Transporter Inhibitors Library (11024 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- GPCR
- Ion Channels
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with Y200-6226 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)