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N-[(2-chlorophenyl)methyl]-4-[N-(prop-2-en-1-yl)methanesulfonamido]benzamide

N-[(2-chlorophenyl)methyl]-4-[N-(prop-2-en-1-yl)methanesulfonamido]benzamide

Formula: C18H19ClN2O3S

SMILES: CS(=O)(=O)N(CC=C)C1=CC=C(C=C1)C(=O)NCC1=CC=CC=C1Cl

IUPAC: N-[(2-chlorophenyl)methyl]-4-[N-(prop-2-en-1-yl)methanesulfonamido]benzamide

InChI: InChI=1S/C18H19ClN2O3S/c1-3-12-21(25(2,23)24)16-10-8-14(9-11-16)18(22)20-13-15-6-4-5-7-17(15)19/h3-11H,1,12-13H2,2H3,(H,20,22)

Composition: C (57.06%), H (5.06%), Cl (9.36%), N (7.39%), O (12.67%), S (8.46%)

Molar Mass: 378.87

Atom Count: 44

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 378.0804914
Formal Charge 0
FSP3 0.17
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey KWIXUYIWWWWEGV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 100.19
Topological Polar Surface Area 66.48
Polarizability 38.91
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 C18H19ClN2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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