Chemical ID: 7468160

c1ccc(cc1)N2CCN(C2c3cccc(c3)Oc4ccccc4)c5ccccc5
Chemical ID:
7468160
Name [?]:
2-(3-phenoxyphenyl)-1,3-diphenyl-imidazolidine
SMILES [?]:
c1ccc(cc1)N2CCN(C2c3cccc(c3)Oc4ccccc4)c5ccccc5
InChi [?]:
InChI=1/C27H24N2O/c1-4-12-23(13-5-1)28-19-20-29(24-14-6-2-7-15-24)27(28)22-11-10-18-26(21-22)30-25-16-8-3-9-17-25/h1-18,21,27H,19-20H2
InChi Info:
AuxInfo=1/0/N:1,28,22,2,6,27,29,21,23,14,13,3,5,26,30,20,24,15,8,9,17,12,4,25,19,16,11,7,10,18/E:(1,2)(4,5,6,7)(8,9)(12,13,14,15)(16,17)(19,20)(23,24)(28,29)/rA:30cCCCCCCNCCNCCCCCCCOCCCCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s7s10;s11;s12;d13;s14;d15;d12s16;s16;s18;s19;d20;s21;d22;d19s23;s10;s25;d26;s27;d28;d25s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C27H24N2O
All Atoms:54
Heavy Atoms:30
Chiral Atoms:2
ZAP Information [?]
Total:11.3435
Area:568.614
Solvation:-2.87189
Coulombic:-25.9741
Bond Count [?]
All:34
Single:22
Double:12
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:392.492
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:7.47
LogP (Chemaxon):7.81

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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