Y030-5758 Screening compound: methyl 2-(4-methoxybenzenesulfonamido)-4-methylpentanoate
Chemical Structure Depiction of ChemDiv screening compound Y030-5758
methyl 2-(4-methoxybenzenesulfonamido)-4-methylpentanoate
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
Y030-5758
Molecular Formula
C14H21NO5S (C14 H21 NO5 S)
Compound Name
methyl 2-(4-methoxybenzenesulfonamido)-4-methylpentanoate
IUPAC name
methyl 2-(4-methoxybenzenesulfonamido)-4-methylpentanoate
SMILES
CC(C)CC(C(OC)=O)NS(c(cc1)ccc1OC)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
315.39
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.668
Distribution Coefficient, logD
2.668
Water Solubility, LogSw
-3.12
Polar Surface Area
70.830
Acid Dissociation Constant (pKa)
11.81
Base Dissociation Constant (pKb)
-7.36
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
50.00
Y030-5758 in Drug Discovery
Included in Screening Libraries
CNS MPO Library (28609 compounds)
Included in 1.7M Stock Database
- Nervous system
References: we are preparing a list of scientific research reports with Y030-5758 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)