V022-1980 Screening compound: N-[3-(tert-butoxy)-2-hydroxypropyl]-N-{[5-(3-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine
Chemical Structure Depiction of ChemDiv screening compound V022-1980
N-[3-(tert-butoxy)-2-hydroxypropyl]-N-{[5-(3-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine
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
V022-1980
Molecular Formula
C28H37N3O4 (C28 H37 N3 O4)
Compound Name
N-[3-(tert-butoxy)-2-hydroxypropyl]-N-{[5-(3-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine
IUPAC name
N-[3-(tert-butoxy)-2-hydroxypropyl]-N-{[5-(3-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}cyclopropanamine
SMILES
CC(C)(C)OCC(CN(Cc(c(-c1ccccc1)nn1C)c1Oc1cc(OC)ccc1)C1CC1)O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
479.62
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
12.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.837
Distribution Coefficient, logD
3.809
Water Solubility, LogSw
-4.75
Polar Surface Area
55.319
Acid Dissociation Constant (pKa)
14.75
Base Dissociation Constant (pKb)
8.39
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
46.40
References: we are preparing a list of scientific research reports with V022-1980 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)