2-{[(2-bromophenyl)methyl]sulfanyl}-N-(2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}ethyl)acetamide

2-{[(2-bromophenyl)methyl]sulfanyl}-N-(2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}ethyl)acetamide

Formula: C18H18BrClFNOS2

SMILES: FC1=C(CSCCNC(=O)CSCC2=CC=CC=C2Br)C(Cl)=CC=C1

IUPAC: 2-{[(2-bromophenyl)methyl]sulfanyl}-N-(2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}ethyl)acetamide

InChI: InChI=1S/C18H18BrClFNOS2/c19-15-5-2-1-4-13(15)10-25-12-18(23)22-8-9-24-11-14-16(20)6-3-7-17(14)21/h1-7H,8-12H2,(H,22,23)

Composition: C (46.71%), H (3.92%), Br (17.26%), Cl (7.66%), F (4.10%), N (3.03%), O (3.46%), S (13.85%)

Molar Mass: 462.82

Atom Count: 43

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	460.968575
Formal Charge	0
FSP3	0.28
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	STTWIHJCVLZQKR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	110.94
Topological Polar Surface Area	29.1
Polarizability	42.65
Ring Count	2
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H18BrClFNOS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00