Text Search
Structure Search

1'-(4-fluorobenzenesulfonyl)-5'-methylspiro[1,3-dioxolane-2,3'-indol]-2'-one

1'-(4-fluorobenzenesulfonyl)-5'-methylspiro[1,3-dioxolane-2,3'-indol]-2'-one

CAS: 866152-08-1

Formula: C17H14FNO5S

SMILES: CC1=CC2=C(C=C1)N(C(=O)C21OCCO1)S(=O)(=O)C1=CC=C(F)C=C1

IUPAC: 1'-(4-fluorobenzenesulfonyl)-5'-methyl-1',2'-dihydrospiro[1,3-dioxolane-2,3'-indol]-2'-one

InChI: InChI=1S/C17H14FNO5S/c1-11-2-7-15-14(10-11)17(23-8-9-24-17)16(20)19(15)25(21,22)13-5-3-12(18)4-6-13/h2-7,10H,8-9H2,1H3

Composition: C (56.19%), H (3.88%), F (5.23%), N (3.85%), O (22.02%), S (8.82%)

Molar Mass: 363.36

Atom Count: 39

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 363.057671892
Formal Charge 0
FSP3 0.24
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey OHTXRHIQQWMTOM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.79
Topological Polar Surface Area 72.91
Polarizability 34.09
Ring Count 4
Rotatable Bond Count 1

Suppliers

No suppliers are currently stocking this item.