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N-(4-phenyl-1,3-thiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide

N-(4-phenyl-1,3-thiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide

Formula: C20H19N3O3S2

SMILES: O=C(NC1=NC(=CS1)C1=CC=CC=C1)C1=CC=C(C=C1)S(=O)(=O)N1CCCC1

IUPAC: N-(4-phenyl-1,3-thiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide

InChI: InChI=1S/C20H19N3O3S2/c24-19(22-20-21-18(14-27-20)15-6-2-1-3-7-15)16-8-10-17(11-9-16)28(25,26)23-12-4-5-13-23/h1-3,6-11,14H,4-5,12-13H2,(H,21,22,24)

Composition: C (58.09%), H (4.63%), N (10.16%), O (11.61%), S (15.51%)

Molar Mass: 413.51

Atom Count: 47

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 413.086783832
Formal Charge 0
FSP3 0.2
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey BPGZJEKGWVFXLY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 110.53
Topological Polar Surface Area 79.37
Polarizability 43.58
Ring Count 4
Rotatable Bond Count 4

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H19N3O3S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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