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Chemical ID: 6462006
Chemical ID:
6462006
Name [?]:
2-[4-(phenyliminomethyl)phenoxy]acetamide
SMILES [?]:
c1ccc(cc1)N=Cc2ccc(cc2)OCC(=O)N
InChi [?]:
InChI=1/C15H14N2O2/c16-15(18)11-19-14-8-6-12(7-9-14)10-17-13-4-2-1-3-5-13/h1-10H,11H2,(H2,16,18)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,10,14,11,13,8,16,9,4,12,17,19,7,18,15/E:(2,3)(4,5)(6,7)(8,9)/rA:19nCCCCCCNCCCCCCCOCCON/rB:s1;d2;s3;d4;d1s5;s4;w7;s8;s9;d10;s11;d12;d9s13;s12;s15;s16;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H14N2O2 |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.57146 |
Area: | 442.515 |
Solvation: | -4.49141 |
Coulombic: | -38.8096 |
Bond Count [?]
All: | 20 |
Single: | 12 |
Double: | 8 |
Rotors: | 5 |
Chiral: | 1 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 254.284 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 1.95 |
LogP (Chemaxon): | 2.67 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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