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4-chloro-N-[2-(morpholine-4-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

4-chloro-N-[2-(morpholine-4-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

Formula: C22H24ClN3O5S

SMILES: ClC1=CC=C(C=C1S(=O)(=O)N1CCCC1)C(=O)NC1=CC=CC=C1C(=O)N1CCOCC1

IUPAC: 4-chloro-N-[2-(morpholine-4-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

InChI: InChI=1S/C22H24ClN3O5S/c23-18-8-7-16(15-20(18)32(29,30)26-9-3-4-10-26)21(27)24-19-6-2-1-5-17(19)22(28)25-11-13-31-14-12-25/h1-2,5-8,15H,3-4,9-14H2,(H,24,27)

Composition: C (55.29%), H (5.06%), Cl (7.42%), N (8.79%), O (16.74%), S (6.71%)

Molar Mass: 477.96

Atom Count: 56

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 477.1125198
Formal Charge 0
FSP3 0.36
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey RKKJBSSDELPCRN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 123.83
Topological Polar Surface Area 96.02
Polarizability 47.01
Ring Count 4
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H24ClN3O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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