Text Search
Structure Search

N-(2-{[(2-chlorophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide

N-(2-{[(2-chlorophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide

Formula: C16H13ClN2OS2

SMILES: CC(=O)NC1=CC=C2N=C(SCC3=CC=CC=C3Cl)SC2=C1

IUPAC: N-(2-{[(2-chlorophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide

InChI: InChI=1S/C16H13ClN2OS2/c1-10(20)18-12-6-7-14-15(8-12)22-16(19-14)21-9-11-4-2-3-5-13(11)17/h2-8H,9H2,1H3,(H,18,20)

Composition: C (55.09%), H (3.76%), Cl (10.16%), N (8.03%), O (4.59%), S (18.38%)

Molar Mass: 348.86

Atom Count: 35

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 348.0157831
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GGSOVEFHPWOARX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.69
Topological Polar Surface Area 41.99
Polarizability 36.87
Ring Count 3
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H13ClN2OS2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote