V030-1739 Screening compound: 5-{4-cyclopentaneamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of ChemDiv screening compound V030-1739
5-{4-cyclopentaneamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic 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
V030-1739
Molecular Formula
C21H28N4O6S (C21 H28 N4 O6 S)
Compound Name
5-{4-cyclopentaneamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
IUPAC name
5-{4-cyclopentaneamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-14-dimethyl-1H-pyrazole-3-carboxylic acid
SMILES
CC(C)NS(c(cc(cc1)NC(C2CCCC2)=O)c1Oc1c(C)c(C(O)=O)nn1C)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
464.54
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
2.017
Distribution Coefficient, logD
-0.696
Water Solubility, LogSw
-2.82
Polar Surface Area
114.897
Acid Dissociation Constant (pKa)
4.69
Base Dissociation Constant (pKb)
-0.27
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
47.60
References: we are preparing a list of scientific research reports with V030-1739 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)