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2-(N-benzyl-4-bromobenzenesulfonamido)-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide

2-(N-benzyl-4-bromobenzenesulfonamido)-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide

Formula: C23H27BrN2O3S

SMILES: BrC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCC1=CCCCC1)CC1=CC=CC=C1

IUPAC: 2-(N-benzyl-4-bromobenzenesulfonamido)-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide

InChI: InChI=1S/C23H27BrN2O3S/c24-21-11-13-22(14-12-21)30(28,29)26(17-20-9-5-2-6-10-20)18-23(27)25-16-15-19-7-3-1-4-8-19/h2,5-7,9-14H,1,3-4,8,15-18H2,(H,25,27)

Composition: C (56.21%), H (5.54%), Br (16.26%), N (5.70%), O (9.77%), S (6.52%)

Molar Mass: 491.44

Atom Count: 57

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 490.092577
Formal Charge 0
FSP3 0.35
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ZWZFYUFGDTZWFS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 124.32
Topological Polar Surface Area 66.48
Polarizability 48.41
Ring Count 3
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H27BrN2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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