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3-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione

3-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione

Formula: C25H18ClN3O3S

SMILES: COC1=CC=CC(=C1)N1C(=O)CC(SC2=NC3=CC=C(Cl)C=C3C(=N2)C2=CC=CC=C2)C1=O

IUPAC: 3-[(6-chloro-4-phenylquinazolin-2-yl)sulfanyl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione

InChI: InChI=1/C25H18ClN3O3S/c1-32-18-9-5-8-17(13-18)29-22(30)14-21(24(29)31)33-25-27-20-11-10-16(26)12-19(20)23(28-25)15-6-3-2-4-7-15/h2-13,21H,14H2,1H3

Composition: C (63.09%), H (3.81%), Cl (7.45%), N (8.83%), O (10.08%), S (6.74%)

Molar Mass: 475.95

Atom Count: 51

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 1
Exact Mass 475.0757403
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey DPUQXEKTJDMRQX-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 127.72
Topological Polar Surface Area 72.39
Polarizability 51.96
Ring Count 5
Rotatable Bond Count 5

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H18ClN3O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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