SD07-0514 Screening compound: 1-({1-[(4-methylpyridin-3-yl)carbonyl]-4'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-3-propylurea
Chemical Structure Depiction of ChemDiv screening compound SD07-0514
1-({1-[(4-methylpyridin-3-yl)carbonyl]-4'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-3-propylurea
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
SD07-0514
Molecular Formula
C20H27N7O3 (C20 H27 N7 O3)
Compound Name
1-({1-[(4-methylpyridin-3-yl)carbonyl]-4'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-3-propylurea
IUPAC name
1-{[1'-(4-methylpyridine-3-carbonyl)-47-dihydrospiro[[123]triazolo[43-c][14]oxazine-63'-pyrrolidin]-3-yl]methyl}-3-propylurea
SMILES
CCCNC(NCc1c(COC(CC2)(CN2C(c2c(C)ccnc2)=O)C2)n2nn1)=O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
413.48
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
-0.012
Distribution Coefficient, logD
-0.012
Water Solubility, LogSw
-1.62
Polar Surface Area
95.608
Acid Dissociation Constant (pKa)
15.64
Base Dissociation Constant (pKb)
4.54
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
55.00
References: we are preparing a list of scientific research reports with SD07-0514 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)