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2-[N-(2-fluorophenyl)-4-methylbenzenesulfonamido]-N-[3-(morpholin-4-yl)propyl]acetamide

2-[N-(2-fluorophenyl)-4-methylbenzenesulfonamido]-N-[3-(morpholin-4-yl)propyl]acetamide

Formula: C22H28FN3O4S

SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN1CCOCC1)C1=CC=CC=C1F

IUPAC: 2-[N-(2-fluorophenyl)-4-methylbenzenesulfonamido]-N-[3-(morpholin-4-yl)propyl]acetamide

InChI: InChI=1S/C22H28FN3O4S/c1-18-7-9-19(10-8-18)31(28,29)26(21-6-3-2-5-20(21)23)17-22(27)24-11-4-12-25-13-15-30-16-14-25/h2-3,5-10H,4,11-17H2,1H3,(H,24,27)

Composition: C (58.78%), H (6.28%), F (4.23%), N (9.35%), O (14.24%), S (7.13%)

Molar Mass: 449.54

Atom Count: 59

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 449.178455731
Formal Charge 0
FSP3 0.41
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey CTURAPXIFAKOPG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 117.81
Topological Polar Surface Area 78.95
Polarizability 45.93
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 C22H28FN3O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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