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BIRT-377 1mg

CAT: 0628-A17202-1Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0628-A17202-1Size:1 mg
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CAS Number
213211-10-0

Chemical Information

Birt 377
CAS Number213211-10-0
PubChem CID9803375
IUPAC Name(5R)-5-[(4-bromophenyl)methyl]-3-(3,5-dichlorophenyl)-1,5-dimethylimidazolidine-2,4-dione
Molecular FormulaC18H15BrCl2N2O2
Molecular Weight442.1
XLogP5
Topological Polar Surface Area40.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity531
SMILES
C[C@]1(C(=O)N(C(=O)N1C)C2=CC(=CC(=C2)Cl)Cl)CC3=CC=C(C=C3)Br
InChI
InChI=1S/C18H15BrCl2N2O2/c1-18(10-11-3-5-12(19)6-4-11)16(24)23(17(25)22(18)2)15-8-13(20)7-14(21)9-15/h3-9H,10H2,1-2H3/t18-/m1/s1
InChIKey
FJNJHZQMQRVZEE-GOSISDBHSA-N
Chemical Structure
2D Structure
2D structure of Birt 377
CAS: 213211-10-0
CID: 9803375
Formula: C18H15BrCl2N2O2
MW: 442.1
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight442.1
XLogP35
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass439.96940
Monoisotopic Mass439.96940
Topological Polar Surface Area40.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity531
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes