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(5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione

(5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione

Formula: C18H12BrClN2O4

SMILES: ClC1=CC2=C(OCO2)C=C1C=C1NC(=O)N(CC2=CC=C(Br)C=C2)C1=O

IUPAC: (5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione

InChI: InChI=1S/C18H12BrClN2O4/c19-12-3-1-10(2-4-12)8-22-17(23)14(21-18(22)24)5-11-6-15-16(7-13(11)20)26-9-25-15/h1-7H,8-9H2,(H,21,24)/b14-5+

Composition: C (49.63%), H (2.78%), Br (18.34%), Cl (8.14%), N (6.43%), O (14.69%)

Molar Mass: 435.66

Atom Count: 38

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 433.966898
Formal Charge 0
FSP3 0.11
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey RAHFQBZJDVSYMF-LHHJGKSTSA-N
Lipinski's Rule of Five 1
Molar Refractivity 99.43
Topological Polar Surface Area 67.87
Polarizability 37.86
Ring Count 4
Rotatable Bond Count 3

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H12BrClN2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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