Y200-5928 Screening compound: 3-{[3-(cyclopentylcarbamoyl)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}propanoic acid
Chemical Structure Depiction of ChemDiv screening compound Y200-5928
3-{[3-(cyclopentylcarbamoyl)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}propanoic acid
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
Y200-5928
Molecular Formula
C23H34N2O4S (C23 H34 N2 O4 S)
Compound Name
3-{[3-(cyclopentylcarbamoyl)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}propanoic acid
IUPAC name
3-{[3-(cyclopentylcarbamoyl)-6-(2-methylbutan-2-yl)-4567-tetrahydro-1-benzothiophen-2-yl]carbamoyl}propanoic acid
SMILES
CCC(C)(C)C(CC1)Cc2c1c(C(NC1CCCC1)=O)c(NC(CCC(O)=O)=O)s2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
434.6
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.608
Distribution Coefficient, logD
0.659
Water Solubility, LogSw
-3.93
Polar Surface Area
75.991
Acid Dissociation Constant (pKa)
4.45
Base Dissociation Constant (pKb)
-2.44
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
69.60
Y200-5928 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Antiviral Library (67538 compounds)
Autophagy-Targeted Library (4564 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Infections
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Eye
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- GPCR
- Ion Channels
- Receptor's ligands
- Epigenetic
References: we are preparing a list of scientific research reports with Y200-5928 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)