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5-(dimethylamino)-N-(4-isothiocyanatophenyl)naphthalene-1-sulfonamide

5-(dimethylamino)-N-(4-isothiocyanatophenyl)naphthalene-1-sulfonamide

CAS: 102417-94-7

Formula: C19H17N3O2S2

SMILES: CN(C)C1=C2C=CC=C(C2=CC=C1)S(=O)(=O)NC1=CC=C(C=C1)N=C=S

IUPAC: 5-(dimethylamino)-N-(4-isothiocyanatophenyl)naphthalene-1-sulfonamide

InChI: InChI=1S/C19H17N3O2S2/c1-22(2)18-7-3-6-17-16(18)5-4-8-19(17)26(23,24)21-15-11-9-14(10-12-15)20-13-25/h3-12,21H,1-2H3

Composition: C (59.51%), H (4.47%), N (10.96%), O (8.34%), S (16.72%)

Molar Mass: 383.48

Atom Count: 43

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 383.076219147
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey MZGXHCHKGRQLHR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 110.83
Topological Polar Surface Area 61.77
Polarizability 43.2
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 102417-94-7 $134.55-$380.88$134.55$380.88
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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 102417-94-7 $43.70-$376.05$43.70$376.05
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