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1-benzyl-3-(2,5-dimethoxybenzenesulfonamido)thiourea

1-benzyl-3-(2,5-dimethoxybenzenesulfonamido)thiourea

Formula: C16H19N3O4S2

SMILES: COC1=CC=C(OC)C(=C1)S(=O)(=O)NNC(=S)NCC1=CC=CC=C1

IUPAC: 1-benzyl-3-(2,5-dimethoxybenzenesulfonamido)thiourea

InChI: InChI=1S/C16H19N3O4S2/c1-22-13-8-9-14(23-2)15(10-13)25(20,21)19-18-16(24)17-11-12-6-4-3-5-7-12/h3-10,19H,11H2,1-2H3,(H2,17,18,24)

Composition: C (50.38%), H (5.02%), N (11.02%), O (16.78%), S (16.81%)

Molar Mass: 381.47

Atom Count: 44

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 381.081698452
Formal Charge 0
FSP3 0.19
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey DINTWYPYSNZRFL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 100.19
Topological Polar Surface Area 88.69
Polarizability 39.64
Ring Count 2
Rotatable Bond Count 6

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H19N3O4S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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