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3-(1,1-dioxo-1??-thiolan-3-yl)-3-(2-hydroxyethyl)-1-(naphthalen-1-yl)urea

3-(1,1-dioxo-1??-thiolan-3-yl)-3-(2-hydroxyethyl)-1-(naphthalen-1-yl)urea

Formula: C17H20N2O4S

SMILES: OCCN(C1CCS(=O)(=O)C1)C(=O)NC1=CC=CC2=CC=CC=C12

IUPAC: 3-(1,1-dioxo-1??-thiolan-3-yl)-3-(2-hydroxyethyl)-1-(naphthalen-1-yl)urea

InChI: InChI=1/C17H20N2O4S/c20-10-9-19(14-8-11-24(22,23)12-14)17(21)18-16-7-3-5-13-4-1-2-6-15(13)16/h1-7,14,20H,8-12H2,(H,18,21)

Composition: C (58.60%), H (5.79%), N (8.04%), O (18.37%), S (9.20%)

Molar Mass: 348.42

Atom Count: 44

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 348.114378306
Formal Charge 0
FSP3 0.35
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey DNFMGFUJVOHDNA-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 92.68
Topological Polar Surface Area 86.71
Polarizability 37.12
Ring Count 3
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H20N2O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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