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Chemical ID: 6496172
Chemical ID:
6496172
Name [?]:
N-[(4-dimethylaminophenyl)methyleneamino]-2-(4-methoxyphenyl)amino-acetamide
SMILES [?]:
CN(C)c1ccc(cc1)C=NNC(=O)CNc2ccc(cc2)OC
InChi [?]:
InChI=1/C18H22N4O2/c1-22(2)16-8-4-14(5-9-16)12-20-21-18(23)13-19-15-6-10-17(24-3)11-7-15/h4-12,19H,13H2,1-3H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,3,24,6,8,18,22,5,9,19,21,10,15,7,17,4,20,13,16,11,12,2,14,23/E:(1,2)(4,5)(6,7)(8,9)(10,11)/rA:24nCNCCCCCCCCNNCOCNCCCCCCOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;w10;s11;s12;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;s20;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H22N4O2 |
All Atoms: | 24 |
Heavy Atoms: | 24 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.69839 |
Area: | 571.719 |
Solvation: | -5.59457 |
Coulombic: | -43.3337 |
Bond Count [?]
All: | 25 |
Single: | 17 |
Double: | 8 |
Rotors: | 8 |
Chiral: | 1 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 326.393 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 6 |
XLogP: | 3.53 |
LogP (Chemaxon): | 2.85 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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