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Chemical ID: 7273820
Chemical ID:
7273820
Name [?]:
N-[4-[2-(4-acetylphenyl)aminoacetyl]aminophenyl]acetamide
SMILES [?]:
CC(=O)c1ccc(cc1)NCC(=O)Nc2ccc(cc2)NC(=O)C
InChi [?]:
InChI=1/C18H19N3O3/c1-12(22)14-3-5-15(6-4-14)19-11-18(24)21-17-9-7-16(8-10-17)20-13(2)23/h3-10,19H,11H2,1-2H3,(H,20,23)(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,24,5,9,6,8,17,19,16,20,11,2,22,4,7,18,15,12,10,21,14,3,23,13/E:(3,4)(5,6)(7,8)(9,10)/rA:24nCCOCCCCCCNCCONCCCCCCNCOC/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s18;s21;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H19N3O3 |
All Atoms: | 43 |
Heavy Atoms: | 24 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.9709 |
Area: | 562.678 |
Solvation: | -5.09606 |
Coulombic: | -57.8767 |
Bond Count [?]
All: | 25 |
Single: | 16 |
Double: | 9 |
Rotors: | 8 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 325.362 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 6 |
XLogP: | 1.08 |
LogP (Chemaxon): | 1.34 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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