N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[N-(4-iodophenyl)methanesulfonamido]acetamide

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[N-(4-iodophenyl)methanesulfonamido]acetamide

Formula: C17H23IN2O3S

SMILES: CS(=O)(=O)N(CC(=O)NCCC1=CCCCC1)C1=CC=C(I)C=C1

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

InChI: InChI=1S/C17H23IN2O3S/c1-24(22,23)20(16-9-7-15(18)8-10-16)13-17(21)19-12-11-14-5-3-2-4-6-14/h5,7-10H,2-4,6,11-13H2,1H3,(H,19,21)

Composition: C (44.16%), H (5.01%), I (27.45%), N (6.06%), O (10.38%), S (6.93%)

Molar Mass: 462.35

Atom Count: 47

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	462.04741
Formal Charge	0
FSP3	0.47
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	OMAWJTGXPUUQPH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.08
Topological Polar Surface Area	66.48
Polarizability	41.27
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H23IN2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00